4-[2-[[2-methyl-4-(4-nitrophenyl)butan-2-yl]amino]-1-oxidanyl-ethyl]phenol hydrochloride

Systemtic Name: 4-[2-[[2-methyl-4-(4-nitrophenyl)butan-2-yl]amino]-1-oxidanyl-ethyl]phenol hydrochloride Openeye Name: 4-[2-[[1,1-dimethyl-3-(4-nitrophenyl)propyl]amino]-1-hydroxy-ethyl]phenol hydrochloride CAS Name: 4-[1-hydroxy-2-[[2-methyl-4-(4-nitrophenyl)butan-2-yl]amino]ethyl]phenol hydrochloride IUPAC Name: 4-[1-hydroxy-2-[[2-methyl-4-(4-nitrophenyl)butan-2-yl]amino]ethyl]phenol hydrochloride Traditional Name: 4-[2-[[1,1-dimethyl-3-(4-nitrophenyl)propyl]amino]-1-hydroxy-ethyl]phenol hydrochloride Formula: C19H25ClN2O4 MolecularWeight: 380.8658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC1=CC=C(C=C1)[N+](=O)[O-])NCC(C2=CC=C(C=C2)O)O.Cl

Isomeric SMILES

CC(C)(CCC1=CC=C(C=C1)[N+](=O)[O-])NCC(C2=CC=C(C=C2)O)O.Cl

InChI

InChI=1S/C19H24N2O4.ClH/c1-19(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;/h3-10,18,20,22-23H,11-13H2,1-2H3;1H