[2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl] quinoline-2-carboxylate

Systemtic Name: [2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl] quinoline-2-carboxylate Openeye Name: [2-(3-chloro-4-cyano-anilino)-2-oxo-ethyl] quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid [2-(3-chloro-4-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-chloro-4-cyanoanilino)-2-oxoethyl] quinoline-2-carboxylate Traditional Name: quinaldic acid [2-(3-chloro-4-cyano-anilino)-2-keto-ethyl] ester Formula: C19H12ClN3O3 MolecularWeight: 365.76988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C(=O)OCC(=O)NC3=CC(=C(C=C3)C#N)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C(=O)OCC(=O)NC3=CC(=C(C=C3)C#N)Cl

InChI

InChI=1S/C19H12ClN3O3/c20-15-9-14(7-5-13(15)10-21)22-18(24)11-26-19(25)17-8-6-12-3-1-2-4-16(12)23-17/h1-9H,11H2,(H,22,24)