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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(S1)NC(=O)C=CC(=O)O)C(=O)OCC

Isomeric SMILES

CCCC1=CC(=C(S1)NC(=O)/C=C\C(=O)O)C(=O)OCC

InChI

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