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

Systemtic Name: (4-ethoxyphenyl) 2-(4-methylphenyl)-1-oxidanylidene-isoquinoline-4-carboxylate Openeye Name: (4-ethoxyphenyl) 1-oxo-2-(p-tolyl)isoquinoline-4-carboxylate CAS Name: 2-(4-methylphenyl)-1-oxo-4-isoquinolinecarboxylic acid (4-ethoxyphenyl) ester IUPAC Name: (4-ethoxyphenyl) 2-(4-methylphenyl)-1-oxoisoquinoline-4-carboxylate Traditional Name: 1-keto-2-(p-tolyl)isoquinoline-4-carboxylic acid p-phenetyl ester Formula: C25H21NO4 MolecularWeight: 399.43854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)OC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H21NO4/c1-3-29-19-12-14-20(15-13-19)30-25(28)23-16-26(18-10-8-17(2)9-11-18)24(27)22-7-5-4-6-21(22)23/h4-16H,3H2,1-2H3