(4-ethoxycarbonylphenyl) 2-(4-methylphenyl)-1-oxidanylidene-isoquinoline-4-carboxylate

Systemtic Name: (4-ethoxycarbonylphenyl) 2-(4-methylphenyl)-1-oxidanylidene-isoquinoline-4-carboxylate Openeye Name: (4-ethoxycarbonylphenyl) 1-oxo-2-(p-tolyl)isoquinoline-4-carboxylate CAS Name: 2-(4-methylphenyl)-1-oxo-4-isoquinolinecarboxylic acid (4-ethoxycarbonylphenyl) ester IUPAC Name: (4-ethoxycarbonylphenyl) 2-(4-methylphenyl)-1-oxoisoquinoline-4-carboxylate Traditional Name: 1-keto-2-(p-tolyl)isoquinoline-4-carboxylic acid (4-carbethoxyphenyl) ester Formula: C26H21NO5 MolecularWeight: 427.44864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)C

InChI

InChI=1S/C26H21NO5/c1-3-31-25(29)18-10-14-20(15-11-18)32-26(30)23-16-27(19-12-8-17(2)9-13-19)24(28)22-7-5-4-6-21(22)23/h4-16H,3H2,1-2H3