(4-propoxyphenyl) 2-(4-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxylate

Systemtic Name: (4-propoxyphenyl) 2-(4-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxylate Openeye Name: (4-propoxyphenyl) 2-(4-methoxyphenyl)-1-oxo-isoquinoline-4-carboxylate CAS Name: 2-(4-methoxyphenyl)-1-oxo-4-isoquinolinecarboxylic acid (4-propoxyphenyl) ester IUPAC Name: (4-propoxyphenyl) 2-(4-methoxyphenyl)-1-oxoisoquinoline-4-carboxylate Traditional Name: 1-keto-2-(4-methoxyphenyl)isoquinoline-4-carboxylic acid (4-propoxyphenyl) ester Formula: C26H23NO5 MolecularWeight: 429.46452

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)OC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)OC

Isomeric SMILES

CCCOC1=CC=C(C=C1)OC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)OC

InChI

InChI=1S/C26H23NO5/c1-3-16-31-20-12-14-21(15-13-20)32-26(29)24-17-27(18-8-10-19(30-2)11-9-18)25(28)23-7-5-4-6-22(23)24/h4-15,17H,3,16H2,1-2H3