(E)-4-[[4-(2-chlorophenyl)-3-methoxycarbonyl-thiophen-2-yl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[4-(2-chlorophenyl)-3-methoxycarbonyl-thiophen-2-yl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[[4-(2-chlorophenyl)-3-methoxycarbonyl-2-thienyl]amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[4-(2-chlorophenyl)-3-methoxycarbonyl-2-thiophenyl]amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[[4-(2-chlorophenyl)-3-methoxycarbonylthiophen-2-yl]amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[[3-carbomethoxy-4-(2-chlorophenyl)-2-thienyl]amino]-4-keto-but-2-enoic acid Formula: C16H12ClNO5S MolecularWeight: 365.78818

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC=CC=C2Cl)NC(=O)C=CC(=O)O

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC=CC=C2Cl)NC(=O)/C=C/C(=O)O

InChI

InChI=1S/C16H12ClNO5S/c1-23-16(22)14-10(9-4-2-3-5-11(9)17)8-24-15(14)18-12(19)6-7-13(20)21/h2-8H,1H3,(H,18,19)(H,20,21)/b7-6+