1-hexylbenzimidazole-2-sulfonic acid

Systemtic Name: 1-hexylbenzimidazole-2-sulfonic acid Openeye Name: 1-hexylbenzimidazole-2-sulfonic acid CAS Name: 1-hexyl-2-benzimidazolesulfonic acid IUPAC Name: 1-hexylbenzimidazole-2-sulfonic acid Traditional Name: 1-hexylbenzimidazole-2-sulfonic acid Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2N=C1S(=O)(=O)O

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2N=C1S(=O)(=O)O

InChI

InChI=1S/C13H18N2O3S/c1-2-3-4-7-10-15-12-9-6-5-8-11(12)14-13(15)19(16,17)18/h5-6,8-9H,2-4,7,10H2,1H3,(H,16,17,18)