(E)-4-[[3-ethoxycarbonyl-4-(4-fluorophenyl)thiophen-2-yl]amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[[3-ethoxycarbonyl-4-(4-fluorophenyl)thiophen-2-yl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[[3-ethoxycarbonyl-4-(4-fluorophenyl)-2-thienyl]amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[3-ethoxycarbonyl-4-(4-fluorophenyl)-2-thiophenyl]amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[[3-ethoxycarbonyl-4-(4-fluorophenyl)thiophen-2-yl]amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[[3-carbethoxy-4-(4-fluorophenyl)-2-thienyl]amino]-4-keto-but-2-enoic acid Formula: C17H14FNO5S MolecularWeight: 363.360163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14FNO5S/c1-2-24-17(23)15-12(10-3-5-11(18)6-4-10)9-25-16(15)19-13(20)7-8-14(21)22/h3-9H,2H2,1H3,(H,19,20)(H,21,22)/b8-7+