[2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl] 2-quinolin-8-ylethanoate

Systemtic Name: [2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl] 2-quinolin-8-ylethanoate Openeye Name: [2-(3-chloro-4-cyano-anilino)-2-oxo-ethyl] 2-(8-quinolyl)acetate CAS Name: 2-(8-quinolinyl)acetic acid [2-(3-chloro-4-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-chloro-4-cyanoanilino)-2-oxoethyl] 2-quinolin-8-ylacetate Traditional Name: 2-(8-quinolyl)acetic acid [2-(3-chloro-4-cyano-anilino)-2-keto-ethyl] ester Formula: C20H14ClN3O3 MolecularWeight: 379.79646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)CC(=O)OCC(=O)NC3=CC(=C(C=C3)C#N)Cl)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)CC(=O)OCC(=O)NC3=CC(=C(C=C3)C#N)Cl)N=CC=C2

InChI

InChI=1S/C20H14ClN3O3/c21-17-10-16(7-6-15(17)11-22)24-18(25)12-27-19(26)9-14-4-1-3-13-5-2-8-23-20(13)14/h1-8,10H,9,12H2,(H,24,25)