[2-(2-acetamidoethylsulfanyl)-2-oxidanylidene-ethyl]azanium; 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: [2-(2-acetamidoethylsulfanyl)-2-oxidanylidene-ethyl]azanium; 2,2,2-tris(fluoranyl)ethanoate Openeye Name: [2-(2-acetamidoethylsulfanyl)-2-oxo-ethyl]ammonium; 2,2,2-trifluoroacetate CAS Name: [2-(2-acetamidoethylthio)-2-oxoethyl]ammonium; 2,2,2-trifluoroacetate IUPAC Name: [2-(2-acetamidoethylsulfanyl)-2-oxoethyl]azanium; 2,2,2-trifluoroacetate Traditional Name: [2-(2-acetamidoethylthio)-2-keto-ethyl]ammonium; 2,2,2-trifluoroacetate Formula: C8H13F3N2O4S MolecularWeight: 290.26003

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCSC(=O)C[NH3+].C(=O)(C(F)(F)F)[O-]

Isomeric SMILES

CC(=O)NCCSC(=O)C[NH3+].C(=O)(C(F)(F)F)[O-]

InChI

InChI=1S/C6H12N2O2S.C2HF3O2/c1-5(9)8-2-3-11-6(10)4-7;3-2(4,5)1(6)7/h2-4,7H2,1H3,(H,8,9);(H,6,7)