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

Systemtic Name: [2-[(5-chloranyl-2-cyano-phenyl)amino]-2-oxidanylidene-ethyl] 4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoate Openeye Name: [2-(5-chloro-2-cyano-anilino)-2-oxo-ethyl] 4-(5-chloro-2-thienyl)-4-oxo-butanoate CAS Name: 4-(5-chloro-2-thiophenyl)-4-oxobutanoic acid [2-(5-chloro-2-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(5-chloro-2-cyanoanilino)-2-oxoethyl] 4-(5-chlorothiophen-2-yl)-4-oxobutanoate Traditional Name: 4-(5-chloro-2-thienyl)-4-keto-butyric acid [2-(5-chloro-2-cyano-anilino)-2-keto-ethyl] ester Formula: C17H12Cl2N2O4S MolecularWeight: 411.25918

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)NC(=O)COC(=O)CCC(=O)C2=CC=C(S2)Cl)C#N

Isomeric SMILES

C1=CC(=C(C=C1Cl)NC(=O)COC(=O)CCC(=O)C2=CC=C(S2)Cl)C#N

InChI

InChI=1S/C17H12Cl2N2O4S/c18-11-2-1-10(8-20)12(7-11)21-16(23)9-25-17(24)6-3-13(22)14-4-5-15(19)26-14/h1-2,4-5,7H,3,6,9H2,(H,21,23)