7-(benzimidazol-1-yl)heptane-1-sulfonic acid

Systemtic Name: 7-(benzimidazol-1-yl)heptane-1-sulfonic acid Openeye Name: 7-(benzimidazol-1-yl)heptane-1-sulfonic acid CAS Name: 7-(1-benzimidazolyl)-1-heptanesulfonic acid IUPAC Name: 7-(benzimidazol-1-yl)heptane-1-sulfonic acid Traditional Name: 7-(benzimidazol-1-yl)heptane-1-sulfonic acid Formula: C14H20N2O3S MolecularWeight: 296.3852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2CCCCCCCS(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2CCCCCCCS(=O)(=O)O

InChI

InChI=1S/C14H20N2O3S/c17-20(18,19)11-7-3-1-2-6-10-16-12-15-13-8-4-5-9-14(13)16/h4-5,8-9,12H,1-3,6-7,10-11H2,(H,17,18,19)