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

Systemtic Name: 4-[(3-methoxycarbonyl-5-methyl-4-phenyl-thiophen-2-yl)amino]-4-oxidanylidene-butanoate Openeye Name: 4-[(3-methoxycarbonyl-5-methyl-4-phenyl-2-thienyl)amino]-4-oxo-butanoate CAS Name: 4-[(3-methoxycarbonyl-5-methyl-4-phenyl-2-thiophenyl)amino]-4-oxobutanoate IUPAC Name: 4-[(3-methoxycarbonyl-5-methyl-4-phenylthiophen-2-yl)amino]-4-oxobutanoate Traditional Name: 4-[(3-carbomethoxy-5-methyl-4-phenyl-2-thienyl)amino]-4-keto-butyrate Formula: C17H16NO5S- MolecularWeight: 346.37764

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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=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO5S/c1-10-14(11-6-4-3-5-7-11)15(17(22)23-2)16(24-10)18-12(19)8-9-13(20)21/h3-7H,8-9H2,1-2H3,(H,18,19)(H,20,21)/p-1