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

Systemtic Name: (Z)-4-[(3-ethoxycarbonyl-4,5-dimethyl-thiophen-2-yl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (Z)-4-[(3-ethoxycarbonyl-4,5-dimethyl-2-thienyl)amino]-4-oxo-but-2-enoic acid CAS Name: (Z)-4-[(3-ethoxycarbonyl-4,5-dimethyl-2-thiophenyl)amino]-4-oxo-2-butenoic acid IUPAC Name: (Z)-4-[(3-ethoxycarbonyl-4,5-dimethylthiophen-2-yl)amino]-4-oxobut-2-enoic acid Traditional Name: (Z)-4-[(3-carbethoxy-4,5-dimethyl-2-thienyl)amino]-4-keto-but-2-enoic acid Formula: C13H15NO5S MolecularWeight: 297.3269

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C=CC(=O)O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)/C=C\C(=O)O

InChI

InChI=1S/C13H15NO5S/c1-4-19-13(18)11-7(2)8(3)20-12(11)14-9(15)5-6-10(16)17/h5-6H,4H2,1-3H3,(H,14,15)(H,16,17)/b6-5-