[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-chloranylquinoline-6-carboxylate

Systemtic Name: [2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-chloranylquinoline-6-carboxylate Openeye Name: [2-(3,4-dimethylanilino)-2-oxo-ethyl] 2-chloroquinoline-6-carboxylate CAS Name: 2-chloro-6-quinolinecarboxylic acid [2-(3,4-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylanilino)-2-oxoethyl] 2-chloroquinoline-6-carboxylate Traditional Name: 2-chloroquinoline-6-carboxylic acid [2-(3,4-dimethylanilino)-2-keto-ethyl] ester Formula: C20H17ClN2O3 MolecularWeight: 368.81358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=CC3=C(C=C2)N=C(C=C3)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=CC3=C(C=C2)N=C(C=C3)Cl)C

InChI

InChI=1S/C20H17ClN2O3/c1-12-3-6-16(9-13(12)2)22-19(24)11-26-20(25)15-4-7-17-14(10-15)5-8-18(21)23-17/h3-10H,11H2,1-2H3,(H,22,24)