4-[(3-methoxycarbonyl-5-phenyl-thiophen-2-yl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3-methoxycarbonyl-5-phenyl-thiophen-2-yl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(3-methoxycarbonyl-5-phenyl-2-thienyl)amino]-4-oxo-butanoic acid CAS Name: 4-[(3-methoxycarbonyl-5-phenyl-2-thiophenyl)amino]-4-oxobutanoic acid IUPAC Name: 4-[(3-methoxycarbonyl-5-phenylthiophen-2-yl)amino]-4-oxobutanoic acid Traditional Name: 4-[(3-carbomethoxy-5-phenyl-2-thienyl)amino]-4-keto-butyric acid Formula: C16H15NO5S MolecularWeight: 333.359

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)CCC(=O)O

Isomeric SMILES

COC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)CCC(=O)O

InChI

InChI=1S/C16H15NO5S/c1-22-16(21)11-9-12(10-5-3-2-4-6-10)23-15(11)17-13(18)7-8-14(19)20/h2-6,9H,7-8H2,1H3,(H,17,18)(H,19,20)