1-(3,4-dimethoxyphenyl)-6,7-diethoxy-2-(4-methylphenyl)-1,4-dihydroisoquinolin-3-one

Systemtic Name: 1-(3,4-dimethoxyphenyl)-6,7-diethoxy-2-(4-methylphenyl)-1,4-dihydroisoquinolin-3-one Openeye Name: 1-(3,4-dimethoxyphenyl)-6,7-diethoxy-2-(p-tolyl)-1,4-dihydroisoquinolin-3-one CAS Name: 1-(3,4-dimethoxyphenyl)-6,7-diethoxy-2-(4-methylphenyl)-1,4-dihydroisoquinolin-3-one IUPAC Name: 1-(3,4-dimethoxyphenyl)-6,7-diethoxy-2-(4-methylphenyl)-1,4-dihydroisoquinolin-3-one Traditional Name: 1-(3,4-dimethoxyphenyl)-6,7-diethoxy-2-(p-tolyl)-1,4-dihydroisoquinolin-3-one Formula: C28H31NO5 MolecularWeight: 461.54944

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(N(C(=O)CC2=C1)C3=CC=C(C=C3)C)C4=CC(=C(C=C4)OC)OC)OCC

Isomeric SMILES

CCOC1=C(C=C2C(N(C(=O)CC2=C1)C3=CC=C(C=C3)C)C4=CC(=C(C=C4)OC)OC)OCC

InChI

InChI=1S/C28H31NO5/c1-6-33-25-15-20-16-27(30)29(21-11-8-18(3)9-12-21)28(22(20)17-26(25)34-7-2)19-10-13-23(31-4)24(14-19)32-5/h8-15,17,28H,6-7,16H2,1-5H3