3-[2-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-2-oxidanyl-propoxy]phenyl]-1-methyl-3-propan-2-yl-4H-quinolin-2-one

Systemtic Name: 3-[2-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-2-oxidanyl-propoxy]phenyl]-1-methyl-3-propan-2-yl-4H-quinolin-2-one Openeye Name: 3-[2-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-2-hydroxy-propoxy]phenyl]-3-isopropyl-1-methyl-4H-quinolin-2-one CAS Name: 3-[2-[3-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-hydroxypropoxy]phenyl]-1-methyl-3-propan-2-yl-4H-quinolin-2-one IUPAC Name: 3-[2-[3-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-hydroxypropoxy]phenyl]-1-methyl-3-propan-2-yl-4H-quinolin-2-one Traditional Name: 3-[2-[3-[homoveratryl(methyl)amino]-2-hydroxy-propoxy]phenyl]-3-isopropyl-1-methyl-4H-quinolin-2-one Formula: C33H42N2O5 MolecularWeight: 546.69698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(CC2=CC=CC=C2N(C1=O)C)C3=CC=CC=C3OCC(CN(C)CCC4=CC(=C(C=C4)OC)OC)O

Isomeric SMILES

CC(C)C1(CC2=CC=CC=C2N(C1=O)C)C3=CC=CC=C3OCC(CN(C)CCC4=CC(=C(C=C4)OC)OC)O

InChI

InChI=1S/C33H42N2O5/c1-23(2)33(20-25-11-7-9-13-28(25)35(4)32(33)37)27-12-8-10-14-29(27)40-22-26(36)21-34(3)18-17-24-15-16-30(38-5)31(19-24)39-6/h7-16,19,23,26,36H,17-18,20-22H2,1-6H3