1-oxidanyl-6-(trifluoromethylsulfonyl)benzimidazole-2-carboxylate

Systemtic Name: 1-oxidanyl-6-(trifluoromethylsulfonyl)benzimidazole-2-carboxylate Openeye Name: 1-hydroxy-6-(trifluoromethylsulfonyl)benzimidazole-2-carboxylate CAS Name: 1-hydroxy-6-(trifluoromethylsulfonyl)-2-benzimidazolecarboxylate IUPAC Name: 1-hydroxy-6-(trifluoromethylsulfonyl)benzimidazole-2-carboxylate Traditional Name: 1-hydroxy-6-triflyl-benzimidazole-2-carboxylate Formula: C9H4F3N2O5S- MolecularWeight: 309.19867

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1S(=O)(=O)C(F)(F)F)N(C(=N2)C(=O)[O-])O

Isomeric SMILES

C1=CC2=C(C=C1S(=O)(=O)C(F)(F)F)N(C(=N2)C(=O)[O-])O

InChI

InChI=1S/C9H5F3N2O5S/c10-9(11,12)20(18,19)4-1-2-5-6(3-4)14(17)7(13-5)8(15)16/h1-3,17H,(H,15,16)/p-1