4-[[4-(4-chlorophenyl)-3-methoxycarbonyl-5-methyl-thiophen-2-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[4-(4-chlorophenyl)-3-methoxycarbonyl-5-methyl-thiophen-2-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[[4-(4-chlorophenyl)-3-methoxycarbonyl-5-methyl-2-thienyl]amino]-4-oxo-butanoate CAS Name: 4-[[4-(4-chlorophenyl)-3-methoxycarbonyl-5-methyl-2-thiophenyl]amino]-4-oxobutanoate IUPAC Name: 4-[[4-(4-chlorophenyl)-3-methoxycarbonyl-5-methylthiophen-2-yl]amino]-4-oxobutanoate Traditional Name: 4-[[3-carbomethoxy-4-(4-chlorophenyl)-5-methyl-2-thienyl]amino]-4-keto-butyrate Formula: C17H15ClNO5S- MolecularWeight: 380.8227

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)CCC(=O)[O-])C(=O)OC)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)CCC(=O)[O-])C(=O)OC)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H16ClNO5S/c1-9-14(10-3-5-11(18)6-4-10)15(17(23)24-2)16(25-9)19-12(20)7-8-13(21)22/h3-6H,7-8H2,1-2H3,(H,19,20)(H,21,22)/p-1