1-butyl-5,6-bis(chloranyl)-2-methyl-3-pentyl-benzimidazol-3-ium

Systemtic Name: 1-butyl-5,6-bis(chloranyl)-2-methyl-3-pentyl-benzimidazol-3-ium Openeye Name: 1-butyl-5,6-dichloro-2-methyl-3-pentyl-benzimidazol-3-ium CAS Name: 1-butyl-5,6-dichloro-2-methyl-3-pentylbenzimidazol-3-ium IUPAC Name: 1-butyl-5,6-dichloro-2-methyl-3-pentylbenzimidazol-3-ium Traditional Name: 1-amyl-3-butyl-5,6-dichloro-2-methyl-benzimidazol-1-ium Formula: C17H25Cl2N2+ MolecularWeight: 328.2998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[N+]1=C(N(C2=CC(=C(C=C21)Cl)Cl)CCCC)C

Isomeric SMILES

CCCCC[N+]1=C(N(C2=CC(=C(C=C21)Cl)Cl)CCCC)C

InChI

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