dimethyl 5-azanyl-3-[[4-(trifluoromethyl)phenyl]carbonyloxymethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[[4-(trifluoromethyl)phenyl]carbonyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[[4-(trifluoromethyl)benzoyl]oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[oxo-[4-(trifluoromethyl)phenyl]methoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[[4-(trifluoromethyl)benzoyl]oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[4-(trifluoromethyl)benzoyl]oxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C17H14F3NO6S MolecularWeight: 417.35637

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1COC(=O)C2=CC=C(C=C2)C(F)(F)F)C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(SC(=C1COC(=O)C2=CC=C(C=C2)C(F)(F)F)C(=O)OC)N

InChI

InChI=1S/C17H14F3NO6S/c1-25-15(23)11-10(12(16(24)26-2)28-13(11)21)7-27-14(22)8-3-5-9(6-4-8)17(18,19)20/h3-6H,7,21H2,1-2H3