4-(benzimidazol-1-yl)butane-1-sulfonic acid

Systemtic Name: 4-(benzimidazol-1-yl)butane-1-sulfonic acid Openeye Name: 4-(benzimidazol-1-yl)butane-1-sulfonic acid CAS Name: 4-(1-benzimidazolyl)-1-butanesulfonic acid IUPAC Name: 4-(benzimidazol-1-yl)butane-1-sulfonic acid Traditional Name: 4-(benzimidazol-1-yl)butane-1-sulfonic acid Formula: C11H14N2O3S MolecularWeight: 254.30546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2CCCCS(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2CCCCS(=O)(=O)O

InChI

InChI=1S/C11H14N2O3S/c14-17(15,16)8-4-3-7-13-9-12-10-5-1-2-6-11(10)13/h1-2,5-6,9H,3-4,7-8H2,(H,14,15,16)