methyl 4-[[2-ethoxycarbonyl-4,4,4-tris(fluoranyl)-3-oxidanylidene-but-1-enyl]amino]thiophene-3-carboxylate

Systemtic Name: methyl 4-[[2-ethoxycarbonyl-4,4,4-tris(fluoranyl)-3-oxidanylidene-but-1-enyl]amino]thiophene-3-carboxylate Openeye Name: methyl 4-[(2-ethoxycarbonyl-4,4,4-trifluoro-3-oxo-but-1-enyl)amino]thiophene-3-carboxylate CAS Name: 4-[(2-ethoxycarbonyl-4,4,4-trifluoro-3-oxobut-1-enyl)amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-[(2-ethoxycarbonyl-4,4,4-trifluoro-3-oxobut-1-enyl)amino]thiophene-3-carboxylate Traditional Name: 4-[(2-carbethoxy-4,4,4-trifluoro-3-keto-but-1-enyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C13H12F3NO5S MolecularWeight: 351.29829

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CSC=C1C(=O)OC)C(=O)C(F)(F)F

Isomeric SMILES

CCOC(=O)C(=CNC1=CSC=C1C(=O)OC)C(=O)C(F)(F)F

InChI

InChI=1S/C13H12F3NO5S/c1-3-22-12(20)7(10(18)13(14,15)16)4-17-9-6-23-5-8(9)11(19)21-2/h4-6,17H,3H2,1-2H3