[2-[(2-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoate

Systemtic Name: [2-[(2-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoate Openeye Name: [2-(2-iodoanilino)-2-oxo-ethyl] 4-(5-chloro-2-thienyl)-4-oxo-butanoate CAS Name: 4-(5-chloro-2-thiophenyl)-4-oxobutanoic acid [2-(2-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-iodoanilino)-2-oxoethyl] 4-(5-chlorothiophen-2-yl)-4-oxobutanoate Traditional Name: 4-(5-chloro-2-thienyl)-4-keto-butyric acid [2-(2-iodoanilino)-2-keto-ethyl] ester Formula: C16H13ClINO4S MolecularWeight: 477.70119

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)COC(=O)CCC(=O)C2=CC=C(S2)Cl)I

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)COC(=O)CCC(=O)C2=CC=C(S2)Cl)I

InChI

InChI=1S/C16H13ClINO4S/c17-14-7-6-13(24-14)12(20)5-8-16(22)23-9-15(21)19-11-4-2-1-3-10(11)18/h1-4,6-7H,5,8-9H2,(H,19,21)