2-(1H-benzimidazol-1-ium-2-ylsulfanyl)ethanoic acid chloride

Systemtic Name: 2-(1H-benzimidazol-1-ium-2-ylsulfanyl)ethanoic acid chloride Openeye Name: 2-(1H-benzimidazol-1-ium-2-ylsulfanyl)acetic acid chloride CAS Name: 2-(1H-benzimidazol-1-ium-2-ylthio)acetic acid chloride IUPAC Name: 2-(1H-benzimidazol-1-ium-2-ylsulfanyl)acetic acid chloride Traditional Name: 2-(1H-benzimidazol-1-ium-2-ylthio)acetic acid chloride Formula: C9H9ClN2O2S MolecularWeight: 244.69796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)[NH2+]C(=N2)SCC(=O)O.[Cl-]

Isomeric SMILES

C1=CC=C2C(=C1)[NH2+]C(=N2)SCC(=O)O.[Cl-]

InChI

InChI=1S/C9H8N2O2S.ClH/c12-8(13)5-14-9-10-6-3-1-2-4-7(6)11-9;/h1-4H,5H2,(H,10,11)(H,12,13);1H