1-(2-sulfonatosulfanylethanoylamino)-3-(trifluoromethyl)benzene

Systemtic Name: 1-(2-sulfonatosulfanylethanoylamino)-3-(trifluoromethyl)benzene Openeye Name: 1-[(2-sulfonatosulfanylacetyl)amino]-3-(trifluoromethyl)benzene CAS Name: 1-[[1-oxo-2-(sulfonatothio)ethyl]amino]-3-(trifluoromethyl)benzene IUPAC Name: 1-[(2-sulfonatosulfanylacetyl)amino]-3-(trifluoromethyl)benzene Traditional Name: 1-[[2-(sulfonatothio)acetyl]amino]-3-(trifluoromethyl)benzene Formula: C9H7F3NO4S2- MolecularWeight: 314.28139

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CSS(=O)(=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CSS(=O)(=O)[O-])C(F)(F)F

InChI

InChI=1S/C9H8F3NO4S2/c10-9(11,12)6-2-1-3-7(4-6)13-8(14)5-18-19(15,16)17/h1-4H,5H2,(H,13,14)(H,15,16,17)/p-1