[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 8-methyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 8-methyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-(2,3-dimethylanilino)-2-oxo-ethyl] 8-methyl-2-phenyl-quinoline-4-carboxylate CAS Name: 8-methyl-2-phenyl-4-quinolinecarboxylic acid [2-(2,3-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dimethylanilino)-2-oxoethyl] 8-methyl-2-phenylquinoline-4-carboxylate Traditional Name: 8-methyl-2-phenyl-cinchoninic acid [2-(2,3-dimethylanilino)-2-keto-ethyl] ester Formula: C27H24N2O3 MolecularWeight: 424.49106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)COC(=O)C2=CC(=NC3=C2C=CC=C3C)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)COC(=O)C2=CC(=NC3=C2C=CC=C3C)C4=CC=CC=C4)C

InChI

InChI=1S/C27H24N2O3/c1-17-9-8-14-23(19(17)3)28-25(30)16-32-27(31)22-15-24(20-11-5-4-6-12-20)29-26-18(2)10-7-13-21(22)26/h4-15H,16H2,1-3H3,(H,28,30)