[2-[(5-chloranyl-2-cyano-phenyl)amino]-2-oxidanylidene-ethyl] 4-(4-fluorophenyl)-4-oxidanylidene-butanoate

Systemtic Name: [2-[(5-chloranyl-2-cyano-phenyl)amino]-2-oxidanylidene-ethyl] 4-(4-fluorophenyl)-4-oxidanylidene-butanoate Openeye Name: [2-(5-chloro-2-cyano-anilino)-2-oxo-ethyl] 4-(4-fluorophenyl)-4-oxo-butanoate CAS Name: 4-(4-fluorophenyl)-4-oxobutanoic acid [2-(5-chloro-2-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(5-chloro-2-cyanoanilino)-2-oxoethyl] 4-(4-fluorophenyl)-4-oxobutanoate Traditional Name: 4-(4-fluorophenyl)-4-keto-butyric acid [2-(5-chloro-2-cyano-anilino)-2-keto-ethyl] ester Formula: C19H14ClFN2O4 MolecularWeight: 388.776863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCC(=O)OCC(=O)NC2=C(C=CC(=C2)Cl)C#N)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCC(=O)OCC(=O)NC2=C(C=CC(=C2)Cl)C#N)F

InChI

InChI=1S/C19H14ClFN2O4/c20-14-4-1-13(10-22)16(9-14)23-18(25)11-27-19(26)8-7-17(24)12-2-5-15(21)6-3-12/h1-6,9H,7-8,11H2,(H,23,25)