2-[3-[[1-(4-methoxyphenyl)-2-methyl-propan-2-yl]amino]-2-oxidanyl-propoxy]-5-pyrrolidin-1-ylcarbonyl-benzenecarbonitrile

Systemtic Name: 2-[3-[[1-(4-methoxyphenyl)-2-methyl-propan-2-yl]amino]-2-oxidanyl-propoxy]-5-pyrrolidin-1-ylcarbonyl-benzenecarbonitrile Openeye Name: 2-[2-hydroxy-3-[[2-(4-methoxyphenyl)-1,1-dimethyl-ethyl]amino]propoxy]-5-(pyrrolidine-1-carbonyl)benzonitrile CAS Name: 2-[2-hydroxy-3-[[1-(4-methoxyphenyl)-2-methylpropan-2-yl]amino]propoxy]-5-[oxo(1-pyrrolidinyl)methyl]benzonitrile IUPAC Name: 2-[2-hydroxy-3-[[1-(4-methoxyphenyl)-2-methylpropan-2-yl]amino]propoxy]-5-(pyrrolidine-1-carbonyl)benzonitrile Traditional Name: 2-[2-hydroxy-3-[[2-(4-methoxyphenyl)-1,1-dimethyl-ethyl]amino]propoxy]-5-(pyrrolidine-1-carbonyl)benzonitrile Formula: C26H33N3O4 MolecularWeight: 451.55792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=C(C=C1)OC)NCC(COC2=C(C=C(C=C2)C(=O)N3CCCC3)C#N)O

Isomeric SMILES

CC(C)(CC1=CC=C(C=C1)OC)NCC(COC2=C(C=C(C=C2)C(=O)N3CCCC3)C#N)O

InChI

InChI=1S/C26H33N3O4/c1-26(2,15-19-6-9-23(32-3)10-7-19)28-17-22(30)18-33-24-11-8-20(14-21(24)16-27)25(31)29-12-4-5-13-29/h6-11,14,22,28,30H,4-5,12-13,15,17-18H2,1-3H3