ethyl 1-(4-methylphenyl)-4-oxidanylidene-3H-isoquinoline-3-carboxylate

Systemtic Name: ethyl 1-(4-methylphenyl)-4-oxidanylidene-3H-isoquinoline-3-carboxylate Openeye Name: ethyl 4-oxo-1-(p-tolyl)-3H-isoquinoline-3-carboxylate CAS Name: 1-(4-methylphenyl)-4-oxo-3H-isoquinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-methylphenyl)-4-oxo-3H-isoquinoline-3-carboxylate Traditional Name: 4-keto-1-(p-tolyl)-3H-isoquinoline-3-carboxylic acid ethyl ester Formula: C19H17NO3 MolecularWeight: 307.34318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(=O)C2=CC=CC=C2C(=N1)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1C(=O)C2=CC=CC=C2C(=N1)C3=CC=C(C=C3)C

InChI

InChI=1S/C19H17NO3/c1-3-23-19(22)17-18(21)15-7-5-4-6-14(15)16(20-17)13-10-8-12(2)9-11-13/h4-11,17H,3H2,1-2H3