3-(1-phenylethyl)-1H-benzimidazol-3-ium-2-sulfonic acid

Systemtic Name: 3-(1-phenylethyl)-1H-benzimidazol-3-ium-2-sulfonic acid Openeye Name: 3-(1-phenylethyl)-1H-benzimidazol-3-ium-2-sulfonic acid CAS Name: 3-(1-phenylethyl)-1H-benzimidazol-3-ium-2-sulfonic acid IUPAC Name: 3-(1-phenylethyl)-1H-benzimidazol-3-ium-2-sulfonic acid Traditional Name: 3-(1-phenylethyl)-1H-benzimidazol-3-ium-2-sulfonic acid Formula: C15H15N2O3S+ MolecularWeight: 303.3562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[N+]2=C(NC3=CC=CC=C32)S(=O)(=O)O

Isomeric SMILES

CC(C1=CC=CC=C1)[N+]2=C(NC3=CC=CC=C32)S(=O)(=O)O

InChI

InChI=1S/C15H14N2O3S/c1-11(12-7-3-2-4-8-12)17-14-10-6-5-9-13(14)16-15(17)21(18,19)20/h2-11H,1H3,(H,18,19,20)/p+1