2-phenyl-3H-benzimidazol-1-ium-5-sulfonate

Systemtic Name: 2-phenyl-3H-benzimidazol-1-ium-5-sulfonate Openeye Name: 2-phenyl-3H-benzimidazol-1-ium-5-sulfonate CAS Name: 2-phenyl-3H-benzimidazol-1-ium-5-sulfonate IUPAC Name: 2-phenyl-3H-benzimidazol-1-ium-5-sulfonate Traditional Name: 2-phenyl-3H-benzimidazol-1-ium-5-sulfonate Formula: C13H10N2O3S MolecularWeight: 274.2951

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=[NH+]C3=C(N2)C=C(C=C3)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=[NH+]C3=C(N2)C=C(C=C3)S(=O)(=O)[O-]

InChI

InChI=1S/C13H10N2O3S/c16-19(17,18)10-6-7-11-12(8-10)15-13(14-11)9-4-2-1-3-5-9/h1-8H,(H,14,15)(H,16,17,18)