3-(1-ethylbenzimidazol-2-yl)propane-1-sulfonic acid

Systemtic Name: 3-(1-ethylbenzimidazol-2-yl)propane-1-sulfonic acid Openeye Name: 3-(1-ethylbenzimidazol-2-yl)propane-1-sulfonic acid CAS Name: 3-(1-ethyl-2-benzimidazolyl)-1-propanesulfonic acid IUPAC Name: 3-(1-ethylbenzimidazol-2-yl)propane-1-sulfonic acid Traditional Name: 3-(1-ethylbenzimidazol-2-yl)propane-1-sulfonic acid Formula: C12H16N2O3S MolecularWeight: 268.33204

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1CCCS(=O)(=O)O

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1CCCS(=O)(=O)O

InChI

InChI=1S/C12H16N2O3S/c1-2-14-11-7-4-3-6-10(11)13-12(14)8-5-9-18(15,16)17/h3-4,6-7H,2,5,8-9H2,1H3,(H,15,16,17)