5,6-bis(chloranyl)-1,2-dimethyl-3-octyl-benzimidazol-1-ium iodide

Systemtic Name: 5,6-bis(chloranyl)-1,2-dimethyl-3-octyl-benzimidazol-1-ium iodide Openeye Name: 5,6-dichloro-1,2-dimethyl-3-octyl-benzimidazol-1-ium iodide CAS Name: 5,6-dichloro-1,2-dimethyl-3-octylbenzimidazol-1-ium iodide IUPAC Name: 5,6-dichloro-1,2-dimethyl-3-octylbenzimidazol-1-ium iodide Traditional Name: 5,6-dichloro-1,2-dimethyl-3-octyl-benzimidazol-1-ium iodide Formula: C17H25Cl2IN2 MolecularWeight: 455.20427

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(=[N+](C2=CC(=C(C=C21)Cl)Cl)C)C.[I-]

Isomeric SMILES

CCCCCCCCN1C(=[N+](C2=CC(=C(C=C21)Cl)Cl)C)C.[I-]

InChI

InChI=1S/C17H25Cl2N2.HI/c1-4-5-6-7-8-9-10-21-13(2)20(3)16-11-14(18)15(19)12-17(16)21;/h11-12H,4-10H2,1-3H3;1H/q+1;/p-1