ethyl 2-methyl-4-(4-methylphenyl)-1-oxidanylidene-isoquinoline-3-carboxylate

Systemtic Name: ethyl 2-methyl-4-(4-methylphenyl)-1-oxidanylidene-isoquinoline-3-carboxylate Openeye Name: ethyl 2-methyl-1-oxo-4-(p-tolyl)isoquinoline-3-carboxylate CAS Name: 2-methyl-4-(4-methylphenyl)-1-oxo-3-isoquinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-4-(4-methylphenyl)-1-oxoisoquinoline-3-carboxylate Traditional Name: 1-keto-2-methyl-4-(p-tolyl)isoquinoline-3-carboxylic acid ethyl ester Formula: C20H19NO3 MolecularWeight: 321.36976

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2C(=O)N1C)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2C(=O)N1C)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H19NO3/c1-4-24-20(23)18-17(14-11-9-13(2)10-12-14)15-7-5-6-8-16(15)19(22)21(18)3/h5-12H,4H2,1-3H3