[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 2,8-dimethylquinoline-4-carboxylate

Systemtic Name: [2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 2,8-dimethylquinoline-4-carboxylate Openeye Name: [2-(3,4-dimethylphenyl)-2-oxo-ethyl] 2,8-dimethylquinoline-4-carboxylate CAS Name: 2,8-dimethyl-4-quinolinecarboxylic acid [2-(3,4-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylphenyl)-2-oxoethyl] 2,8-dimethylquinoline-4-carboxylate Traditional Name: 2,8-dimethylcinchoninic acid [2-(3,4-dimethylphenyl)-2-keto-ethyl] ester Formula: C22H21NO3 MolecularWeight: 347.40704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)COC(=O)C2=CC(=NC3=C2C=CC=C3C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)COC(=O)C2=CC(=NC3=C2C=CC=C3C)C)C

InChI

InChI=1S/C22H21NO3/c1-13-8-9-17(10-15(13)3)20(24)12-26-22(25)19-11-16(4)23-21-14(2)6-5-7-18(19)21/h5-11H,12H2,1-4H3