[2-(4-methylphenyl)-2-oxidanylidene-ethyl] 2,3-dimethylquinoline-4-carboxylate

Systemtic Name: [2-(4-methylphenyl)-2-oxidanylidene-ethyl] 2,3-dimethylquinoline-4-carboxylate Openeye Name: [2-oxo-2-(p-tolyl)ethyl] 2,3-dimethylquinoline-4-carboxylate CAS Name: 2,3-dimethyl-4-quinolinecarboxylic acid [2-(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylphenyl)-2-oxoethyl] 2,3-dimethylquinoline-4-carboxylate Traditional Name: 2,3-dimethylcinchoninic acid [2-keto-2-(p-tolyl)ethyl] ester Formula: C21H19NO3 MolecularWeight: 333.38046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)COC(=O)C2=C(C(=NC3=CC=CC=C32)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)COC(=O)C2=C(C(=NC3=CC=CC=C32)C)C

InChI

InChI=1S/C21H19NO3/c1-13-8-10-16(11-9-13)19(23)12-25-21(24)20-14(2)15(3)22-18-7-5-4-6-17(18)20/h4-11H,12H2,1-3H3