4-[(2-ethoxycarbonyl-5-ethyl-thiophen-3-yl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(2-ethoxycarbonyl-5-ethyl-thiophen-3-yl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(2-ethoxycarbonyl-5-ethyl-3-thienyl)amino]-4-oxo-butanoic acid CAS Name: 4-[(2-ethoxycarbonyl-5-ethyl-3-thiophenyl)amino]-4-oxobutanoic acid IUPAC Name: 4-[(2-ethoxycarbonyl-5-ethylthiophen-3-yl)amino]-4-oxobutanoic acid Traditional Name: 4-[(2-carbethoxy-5-ethyl-3-thienyl)amino]-4-keto-butyric acid Formula: C13H17NO5S MolecularWeight: 299.34278

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)C(=O)OCC)NC(=O)CCC(=O)O

Isomeric SMILES

CCC1=CC(=C(S1)C(=O)OCC)NC(=O)CCC(=O)O

InChI

InChI=1S/C13H17NO5S/c1-3-8-7-9(12(20-8)13(18)19-4-2)14-10(15)5-6-11(16)17/h7H,3-6H2,1-2H3,(H,14,15)(H,16,17)