1-pentylbenzimidazole-2-sulfonic acid

Systemtic Name: 1-pentylbenzimidazole-2-sulfonic acid Openeye Name: 1-pentylbenzimidazole-2-sulfonic acid CAS Name: 1-pentyl-2-benzimidazolesulfonic acid IUPAC Name: 1-pentylbenzimidazole-2-sulfonic acid Traditional Name: 1-amylbenzimidazole-2-sulfonic acid Formula: C12H16N2O3S MolecularWeight: 268.33204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=CC=CC=C2N=C1S(=O)(=O)O

Isomeric SMILES

CCCCCN1C2=CC=CC=C2N=C1S(=O)(=O)O

InChI

InChI=1S/C12H16N2O3S/c1-2-3-6-9-14-11-8-5-4-7-10(11)13-12(14)18(15,16)17/h4-5,7-8H,2-3,6,9H2,1H3,(H,15,16,17)