(2-azanyl-2-oxidanylidene-ethyl) 4-(trifluoromethylsulfanyl)benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 4-(trifluoromethylsulfanyl)benzoate Openeye Name: (2-amino-2-oxo-ethyl) 4-(trifluoromethylsulfanyl)benzoate CAS Name: 4-(trifluoromethylthio)benzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 4-(trifluoromethylsulfanyl)benzoate Traditional Name: 4-(trifluoromethylthio)benzoic acid (2-amino-2-keto-ethyl) ester Formula: C10H8F3NO3S MolecularWeight: 279.23563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC(=O)N)SC(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC(=O)N)SC(F)(F)F

InChI

InChI=1S/C10H8F3NO3S/c11-10(12,13)18-7-3-1-6(2-4-7)9(16)17-5-8(14)15/h1-4H,5H2,(H2,14,15)