2-azanyl-5-nitro-4-(trifluoromethyl)benzenesulfonic acid

Systemtic Name: 2-azanyl-5-nitro-4-(trifluoromethyl)benzenesulfonic acid Openeye Name: 2-amino-5-nitro-4-(trifluoromethyl)benzenesulfonic acid CAS Name: 2-amino-5-nitro-4-(trifluoromethyl)benzenesulfonic acid IUPAC Name: 2-amino-5-nitro-4-(trifluoromethyl)benzenesulfonic acid Traditional Name: 2-amino-5-nitro-4-(trifluoromethyl)besylic acid Formula: C7H5F3N2O5S MolecularWeight: 286.18521

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1N)S(=O)(=O)O)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=C(C(=CC(=C1N)S(=O)(=O)O)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C7H5F3N2O5S/c8-7(9,10)3-1-4(11)6(18(15,16)17)2-5(3)12(13)14/h1-2H,11H2,(H,15,16,17)