3-[4-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]propoxy]phenyl]-7-methoxy-2-methyl-isoquinolin-1-one

Systemtic Name: 3-[4-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]propoxy]phenyl]-7-methoxy-2-methyl-isoquinolin-1-one Openeye Name: 3-[4-[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]propoxy]phenyl]-7-methoxy-2-methyl-isoquinolin-1-one CAS Name: 3-[4-[3-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]propoxy]phenyl]-7-methoxy-2-methyl-1-isoquinolinone IUPAC Name: 3-[4-[3-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]propoxy]phenyl]-7-methoxy-2-methylisoquinolin-1-one Traditional Name: 3-[4-[3-[homoveratryl(methyl)amino]propoxy]phenyl]-7-methoxy-2-methyl-isocarbostyril Formula: C31H36N2O5 MolecularWeight: 516.62794

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=C(C1=O)C=C(C=C2)OC)C3=CC=C(C=C3)OCCCN(C)CCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CN1C(=CC2=C(C1=O)C=C(C=C2)OC)C3=CC=C(C=C3)OCCCN(C)CCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C31H36N2O5/c1-32(17-15-22-7-14-29(36-4)30(19-22)37-5)16-6-18-38-25-11-8-23(9-12-25)28-20-24-10-13-26(35-3)21-27(24)31(34)33(28)2/h7-14,19-21H,6,15-18H2,1-5H3