2-azanyl-5-[2-(butan-2-ylamino)-1-oxidanyl-ethyl]benzenecarbonitrile; 2-azanyl-5-[2-(tert-butylamino)-1-oxidanyl-ethyl]benzenecarbonitrile; 2-[4-(4-fluorophenyl)butan-2-ylamino]-1-phenyl-ethanol; 2-[[4-(4-fluorophenyl)-2-methyl-butan-2-yl]amino]-1-phenyl-ethanol; 4-[3-[[2-(4-hydroxyphenyl)-2-oxidanyl-ethyl]amino]-3-methyl-butyl]phenol; 4-[3-[[2-(4-methoxyphenyl)-2-oxidanyl-ethyl]amino]-3-methyl-butyl]phenol; 4-[2-[[2-methyl-4-(4-nitrophenyl)butan-2-yl]amino]-1-oxidanyl-ethyl]phenol; 4-[2-[(2-methyl-4-phenyl

Systemtic Name: 2-azanyl-5-[2-(butan-2-ylamino)-1-oxidanyl-ethyl]benzenecarbonitrile; 2-azanyl-5-[2-(tert-butylamino)-1-oxidanyl-ethyl]benzenecarbonitrile; 2-[4-(4-fluorophenyl)butan-2-ylamino]-1-phenyl-ethanol; 2-[[4-(4-fluorophenyl)-2-methyl-butan-2-yl]amino]-1-phenyl-ethanol; 4-[3-[[2-(4-hydroxyphenyl)-2-oxidanyl-ethyl]amino]-3-methyl-butyl]phenol; 4-[3-[[2-(4-methoxyphenyl)-2-oxidanyl-ethyl]amino]-3-methyl-butyl]phenol; 4-[2-[[2-methyl-4-(4-nitrophenyl)butan-2-yl]amino]-1-oxidanyl-ethyl]phenol; 4-[2-[(2-methyl-4-phenyl Openeye Name: 2-amino-5-[2-(tert-butylamino)-1-hydroxy-ethyl]benzonitrile; 2-amino-5-[1-hydroxy-2-(sec-butylamino)ethyl]benzonitrile; 4-[2-[[1,1-dimethyl-3-(4-nitrophenyl)propyl]amino]-1-hydroxy-ethyl]phenol; 4-[2-[(1,1-dimethyl-3-phenyl-propyl)amino]-1-hydroxy-ethyl]phenol; 2-[[3-(4-fluorophenyl)-1,1-dimethyl-propyl]amino]-1-phenyl-ethanol; 2-[[3-(4-fluorophenyl)-1-methyl-propyl]amino]-1-phenyl-ethanol; 4-[3-[[2-hydroxy-2-(4-hydroxyphenyl)ethyl]amino]-3-methyl-butyl]phenol; 3-[1-hydroxy-2-(isopropylamino)ethyl]benzonitr CAS Name: 2-amino-5-[2-(butan-2-ylamino)-1-hydroxyethyl]benzonitrile; 2-amino-5-[2-(tert-butylamino)-1-hydroxyethyl]benzonitrile; 2-[4-(4-fluorophenyl)butan-2-ylamino]-1-phenylethanol; 2-[[4-(4-fluorophenyl)-2-methylbutan-2-yl]amino]-1-phenylethanol; 4-[3-[[2-hydroxy-2-(4-hydroxyphenyl)ethyl]amino]-3-methylbutyl]phenol; 4-[3-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]-3-methylbutyl]phenol; 4-[1-hydroxy-2-[[2-methyl-4-(4-nitrophenyl)butan-2-yl]amino]ethyl]phenol; 4-[1-hydroxy-2-[(2-methyl-4-phenylbutan-2-yl)amino]ethy IUPAC Name: 2-amino-5-[2-(butan-2-ylamino)-1-hydroxyethyl]benzonitrile; 2-amino-5-[2-(tert-butylamino)-1-hydroxyethyl]benzonitrile; 2-[4-(4-fluorophenyl)butan-2-ylamino]-1-phenylethanol; 2-[[4-(4-fluorophenyl)-2-methylbutan-2-yl]amino]-1-phenylethanol; 4-[3-[[2-hydroxy-2-(4-hydroxyphenyl)ethyl]amino]-3-methylbutyl]phenol; 4-[3-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]-3-methylbutyl]phenol; 4-[1-hydroxy-2-[[2-methyl-4-(4-nitrophenyl)butan-2-yl]amino]ethyl]phenol; 4-[1-hydroxy-2-[(2-methyl-4-phenylbutan-2-yl)amino]ethy Traditional Name: 2-amino-5-[2-(tert-butylamino)-1-hydroxy-ethyl]benzonitrile; 2-amino-5-[1-hydroxy-2-(sec-butylamino)ethyl]benzonitrile; 4-[2-[[1,1-dimethyl-3-(4-nitrophenyl)propyl]amino]-1-hydroxy-ethyl]phenol; 4-[2-[(1,1-dimethyl-3-phenyl-propyl)amino]-1-hydroxy-ethyl]phenol; 2-[[3-(4-fluorophenyl)-1,1-dimethyl-propyl]amino]-1-phenyl-ethanol; 2-[[3-(4-fluorophenyl)-1-methyl-propyl]amino]-1-phenyl-ethanol; 4-[3-[[2-hydroxy-2-(4-hydroxyphenyl)ethyl]amino]-3-methyl-butyl]phenol; 3-[1-hydroxy-2-(isopropylamino)ethyl]benzonitr Formula: C152H201F2N15O17 MolecularWeight: 2548.309446

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCC(C1=CC(=C(C=C1)N)C#N)O.CC(C)NCC(C1=CC=CC(=C1)C#N)O.CC(CCC1=CC=C(C=C1)F)NCC(C2=CC=CC=C2)O.CC(C)(C)NCC(C1=CC(=C(C=C1)N)C#N)O.CC(C)(CCC1=CC=CC=C1)NCC(C2=CC=C(C=C2)O)O.CC(C)(CCC1=CC=C(C=C1)[N+](=O)[O-])NCC(C2=CC=C(C=C2)O)O.CC(C)(CCC1=CC=C(C=C1)O)NCC(C2=CC=C(C=C2)O)O.CC(C)(CCC1=CC=C(C=C1)O)NCC(C2=CC=C(C=C2)OC)O.CC(C)(CCC1=CC=C(C=C1)F)NCC(C2=CC=CC=C2)O

Isomeric SMILES

CCC(C)NCC(C1=CC(=C(C=C1)N)C#N)O.CC(C)NCC(C1=CC=CC(=C1)C#N)O.CC(CCC1=CC=C(C=C1)F)NCC(C2=CC=CC=C2)O.CC(C)(C)NCC(C1=CC(=C(C=C1)N)C#N)O.CC(C)(CCC1=CC=CC=C1)NCC(C2=CC=C(C=C2)O)O.CC(C)(CCC1=CC=C(C=C1)[N+](=O)[O-])NCC(C2=CC=C(C=C2)O)O.CC(C)(CCC1=CC=C(C=C1)O)NCC(C2=CC=C(C=C2)O)O.CC(C)(CCC1=CC=C(C=C1)O)NCC(C2=CC=C(C=C2)OC)O.CC(C)(CCC1=CC=C(C=C1)F)NCC(C2=CC=CC=C2)O

InChI

InChI=1S/C20H27NO3.C19H24FNO.C19H24N2O4.C19H25NO3.C19H25NO2.C18H22FNO.2C13H19N3O.C12H16N2O/c1-20(2,13-12-15-4-8-17(22)9-5-15)21-14-19(23)16-6-10-18(24-3)11-7-16;1-19(2,13-12-15-8-10-17(20)11-9-15)21-14-18(22)16-6-4-3-5-7-16;1-19(2,12-11-14-3-7-16(8-4-14)21(24)25)20-13-18(23)15-5-9-17(22)10-6-15;1-19(2,12-11-14-3-7-16(21)8-4-14)20-13-18(23)15-5-9-17(22)10-6-15;1-19(2,13-12-15-6-4-3-5-7-15)20-14-18(22)16-8-10-17(21)11-9-16;1-14(7-8-15-9-11-17(19)12-10-15)20-13-18(21)16-5-3-2-4-6-16;1-13(2,3)16-8-12(17)9-4-5-11(15)10(6-9)7-14;1-3-9(2)16-8-13(17)10-4-5-12(15)11(6-10)7-14;1-9(2)14-8-12(15)11-5-3-4-10(6-11)7-13/h4-11,19,21-23H,12-14H2,1-3H3;3-11,18,21-22H,12-14H2,1-2H3;3-10,18,20,22-23H,11-13H2,1-2H3;3-10,18,20-23H,11-13H2,1-2H3;3-11,18,20-22H,12-14H2,1-2H3;2-6,9-12,14,18,20-21H,7-8,13H2,1H3;4-6,12,16-17H,8,15H2,1-3H3;4-6,9,13,16-17H,3,8,15H2,1-2H3;3-6,9,12,14-15H,8H2,1-2H3