2-[[4-azanyl-3-(trifluoromethyl)phenyl]sulfonylamino]ethanesulfonic acid

Systemtic Name: 2-[[4-azanyl-3-(trifluoromethyl)phenyl]sulfonylamino]ethanesulfonic acid Openeye Name: 2-[[4-amino-3-(trifluoromethyl)phenyl]sulfonylamino]ethanesulfonic acid CAS Name: 2-[[4-amino-3-(trifluoromethyl)phenyl]sulfonylamino]ethanesulfonic acid IUPAC Name: 2-[[4-amino-3-(trifluoromethyl)phenyl]sulfonylamino]ethanesulfonic acid Traditional Name: 2-[[4-amino-3-(trifluoromethyl)phenyl]sulfonylamino]ethanesulfonic acid Formula: C9H11F3N2O5S2 MolecularWeight: 348.31925

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)NCCS(=O)(=O)O)C(F)(F)F)N

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)NCCS(=O)(=O)O)C(F)(F)F)N

InChI

InChI=1S/C9H11F3N2O5S2/c10-9(11,12)7-5-6(1-2-8(7)13)21(18,19)14-3-4-20(15,16)17/h1-2,5,14H,3-4,13H2,(H,15,16,17)