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

Systemtic Name: 4-[(3-ethoxycarbonyl-5-methyl-4-phenyl-thiophen-2-yl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: 4-[(3-ethoxycarbonyl-5-methyl-4-phenyl-2-thienyl)amino]-4-oxo-but-2-enoic acid CAS Name: 4-[(3-ethoxycarbonyl-5-methyl-4-phenyl-2-thiophenyl)amino]-4-oxo-2-butenoic acid IUPAC Name: 4-[(3-ethoxycarbonyl-5-methyl-4-phenylthiophen-2-yl)amino]-4-oxobut-2-enoic acid Traditional Name: 4-[(3-carbethoxy-5-methyl-4-phenyl-2-thienyl)amino]-4-keto-but-2-enoic acid Formula: C18H17NO5S MolecularWeight: 359.39628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=O)C=CC(=O)O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=O)C=CC(=O)O

InChI

InChI=1S/C18H17NO5S/c1-3-24-18(23)16-15(12-7-5-4-6-8-12)11(2)25-17(16)19-13(20)9-10-14(21)22/h4-10H,3H2,1-2H3,(H,19,20)(H,21,22)