methyl 2-[[2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxidanylidene-isoquinolin-4-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxidanylidene-isoquinolin-4-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxo-isoquinoline-4-carbonyl]amino]benzoate CAS Name: 2-[[[2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxo-4-isoquinolinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxoisoquinoline-4-carbonyl]amino]benzoate Traditional Name: 2-[(1-keto-6,7-dimethoxy-2-p-phenetyl-isoquinoline-4-carbonyl)amino]benzoic acid methyl ester Formula: C28H26N2O7 MolecularWeight: 502.51524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C=C(C3=CC(=C(C=C3C2=O)OC)OC)C(=O)NC4=CC=CC=C4C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C=C(C3=CC(=C(C=C3C2=O)OC)OC)C(=O)NC4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C28H26N2O7/c1-5-37-18-12-10-17(11-13-18)30-16-22(20-14-24(34-2)25(35-3)15-21(20)27(30)32)26(31)29-23-9-7-6-8-19(23)28(33)36-4/h6-16H,5H2,1-4H3,(H,29,31)