[(2S)-1-oxidanylidene-1-phenylmethoxy-5-sulfamoyl-pentan-2-yl]azanium; 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: [(2S)-1-oxidanylidene-1-phenylmethoxy-5-sulfamoyl-pentan-2-yl]azanium; 2,2,2-tris(fluoranyl)ethanoate Openeye Name: [(1S)-1-benzyloxycarbonyl-4-sulfamoyl-butyl]ammonium; 2,2,2-trifluoroacetate CAS Name: [(2S)-1-oxo-1-phenylmethoxy-5-sulfamoylpentan-2-yl]ammonium; 2,2,2-trifluoroacetate IUPAC Name: [(2S)-1-oxo-1-phenylmethoxy-5-sulfamoylpentan-2-yl]azanium; 2,2,2-trifluoroacetate Traditional Name: [(1S)-1-carbobenzoxy-4-sulfamoyl-butyl]ammonium; 2,2,2-trifluoroacetate Formula: C14H19F3N2O6S MolecularWeight: 400.37067

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CCCS(=O)(=O)N)[NH3+].C(=O)(C(F)(F)F)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)[C@H](CCCS(=O)(=O)N)[NH3+].C(=O)(C(F)(F)F)[O-]

InChI

InChI=1S/C12H18N2O4S.C2HF3O2/c13-11(7-4-8-19(14,16)17)12(15)18-9-10-5-2-1-3-6-10;3-2(4,5)1(6)7/h1-3,5-6,11H,4,7-9,13H2,(H2,14,16,17);(H,6,7)/t11-;/m0./s1