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

Systemtic Name: 6,7-diethoxy-1-(4-methoxyphenyl)-2-(4-methylphenyl)-1,4-dihydroisoquinolin-3-one Openeye Name: 6,7-diethoxy-1-(4-methoxyphenyl)-2-(p-tolyl)-1,4-dihydroisoquinolin-3-one CAS Name: 6,7-diethoxy-1-(4-methoxyphenyl)-2-(4-methylphenyl)-1,4-dihydroisoquinolin-3-one IUPAC Name: 6,7-diethoxy-1-(4-methoxyphenyl)-2-(4-methylphenyl)-1,4-dihydroisoquinolin-3-one Traditional Name: 6,7-diethoxy-1-(4-methoxyphenyl)-2-(p-tolyl)-1,4-dihydroisoquinolin-3-one Formula: C27H29NO4 MolecularWeight: 431.52346

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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)OCC

Isomeric SMILES

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

InChI

InChI=1S/C27H29NO4/c1-5-31-24-15-20-16-26(29)28(21-11-7-18(3)8-12-21)27(23(20)17-25(24)32-6-2)19-9-13-22(30-4)14-10-19/h7-15,17,27H,5-6,16H2,1-4H3