(Z)-4-[(3-ethoxycarbonyl-4-ethyl-5-methyl-thiophen-2-yl)amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (Z)-4-[(3-ethoxycarbonyl-4-ethyl-5-methyl-thiophen-2-yl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (Z)-4-[(3-ethoxycarbonyl-4-ethyl-5-methyl-2-thienyl)amino]-4-oxo-but-2-enoic acid CAS Name: (Z)-4-[(3-ethoxycarbonyl-4-ethyl-5-methyl-2-thiophenyl)amino]-4-oxo-2-butenoic acid IUPAC Name: (Z)-4-[(3-ethoxycarbonyl-4-ethyl-5-methylthiophen-2-yl)amino]-4-oxobut-2-enoic acid Traditional Name: (Z)-4-[(3-carbethoxy-4-ethyl-5-methyl-2-thienyl)amino]-4-keto-but-2-enoic acid Formula: C14H17NO5S MolecularWeight: 311.35348

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=O)C=CC(=O)O)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=O)/C=C\C(=O)O)C

InChI

InChI=1S/C14H17NO5S/c1-4-9-8(3)21-13(12(9)14(19)20-5-2)15-10(16)6-7-11(17)18/h6-7H,4-5H2,1-3H3,(H,15,16)(H,17,18)/b7-6-