3-(4-chloranylbutyl)-1-hexyl-1-oxidanidyl-2H-benzimidazol-1-ium

Systemtic Name: 3-(4-chloranylbutyl)-1-hexyl-1-oxidanidyl-2H-benzimidazol-1-ium Openeye Name: 3-(4-chlorobutyl)-1-hexyl-1-oxido-2H-benzimidazol-1-ium CAS Name: 3-(4-chlorobutyl)-1-hexyl-1-oxido-2H-benzimidazol-1-ium IUPAC Name: 3-(4-chlorobutyl)-1-hexyl-1-oxido-2H-benzimidazol-1-ium Traditional Name: 3-(4-chlorobutyl)-1-hexyl-1-oxido-2H-benzimidazol-1-ium Formula: C17H27ClN2O MolecularWeight: 310.86208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[N+]1(CN(C2=CC=CC=C21)CCCCCl)[O-]

Isomeric SMILES

CCCCCC[N+]1(CN(C2=CC=CC=C21)CCCCCl)[O-]

InChI

InChI=1S/C17H27ClN2O/c1-2-3-4-9-14-20(21)15-19(13-8-7-12-18)16-10-5-6-11-17(16)20/h5-6,10-11H,2-4,7-9,12-15H2,1H3