3-azanyl-4-(trifluoromethyl)benzenesulfonic acid

Systemtic Name: 3-azanyl-4-(trifluoromethyl)benzenesulfonic acid Openeye Name: 3-amino-4-(trifluoromethyl)benzenesulfonic acid CAS Name: 3-amino-4-(trifluoromethyl)benzenesulfonic acid IUPAC Name: 3-amino-4-(trifluoromethyl)benzenesulfonic acid Traditional Name: 3-amino-4-(trifluoromethyl)besylic acid Formula: C7H6F3NO3S MolecularWeight: 241.18765

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H6F3NO3S/c8-7(9,10)5-2-1-4(3-6(5)11)15(12,13)14/h1-3H,11H2,(H,12,13,14)