2-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]benzenesulfonic acid

Systemtic Name: 2-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]benzenesulfonic acid Openeye Name: 2-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]benzenesulfonic acid CAS Name: 2-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]benzenesulfonic acid IUPAC Name: 2-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]benzenesulfonic acid Traditional Name: 2-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]besylic acid Formula: C14H9F3N2O3S MolecularWeight: 342.29307

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=C(N2)C=C(C=C3)C(F)(F)F)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=C(N2)C=C(C=C3)C(F)(F)F)S(=O)(=O)O

InChI

InChI=1S/C14H9F3N2O3S/c15-14(16,17)8-5-6-10-11(7-8)19-13(18-10)9-3-1-2-4-12(9)23(20,21)22/h1-7H,(H,18,19)(H,20,21,22)