2-[[2-(trifluoromethylsulfonyl)phenyl]azaniumyl]ethanoate

Systemtic Name: 2-[[2-(trifluoromethylsulfonyl)phenyl]azaniumyl]ethanoate Openeye Name: 2-[[2-(trifluoromethylsulfonyl)phenyl]ammonio]acetate CAS Name: 2-[[2-(trifluoromethylsulfonyl)phenyl]ammonio]acetate IUPAC Name: 2-[[2-(trifluoromethylsulfonyl)phenyl]azaniumyl]acetate Traditional Name: 2-[(2-triflylphenyl)ammonio]acetate Formula: C9H8F3NO4S MolecularWeight: 283.22433

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[NH2+]CC(=O)[O-])S(=O)(=O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)[NH2+]CC(=O)[O-])S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C9H8F3NO4S/c10-9(11,12)18(16,17)7-4-2-1-3-6(7)13-5-8(14)15/h1-4,13H,5H2,(H,14,15)