6-(benzimidazol-1-yl)hexane-1-sulfonic acid

Systemtic Name: 6-(benzimidazol-1-yl)hexane-1-sulfonic acid Openeye Name: 6-(benzimidazol-1-yl)hexane-1-sulfonic acid CAS Name: 6-(1-benzimidazolyl)-1-hexanesulfonic acid IUPAC Name: 6-(benzimidazol-1-yl)hexane-1-sulfonic acid Traditional Name: 6-(benzimidazol-1-yl)hexane-1-sulfonic acid Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2CCCCCCS(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2CCCCCCS(=O)(=O)O

InChI

InChI=1S/C13H18N2O3S/c16-19(17,18)10-6-2-1-5-9-15-11-14-12-7-3-4-8-13(12)15/h3-4,7-8,11H,1-2,5-6,9-10H2,(H,16,17,18)