1-butyl-3-[(1S)-1-cyclohexylethyl]benzimidazol-1-ium

Systemtic Name: 1-butyl-3-[(1S)-1-cyclohexylethyl]benzimidazol-1-ium Openeye Name: 1-butyl-3-[(1S)-1-cyclohexylethyl]benzimidazol-1-ium CAS Name: 1-butyl-3-[(1S)-1-cyclohexylethyl]benzimidazol-1-ium IUPAC Name: 1-butyl-3-[(1S)-1-cyclohexylethyl]benzimidazol-1-ium Traditional Name: 1-butyl-3-[(1S)-1-cyclohexylethyl]benzimidazol-1-ium Formula: C19H29N2+ MolecularWeight: 285.44696

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=CN(C2=CC=CC=C21)C(C)C3CCCCC3

Isomeric SMILES

CCCC[N+]1=CN(C2=CC=CC=C21)[C@@H](C)C3CCCCC3

InChI

InChI=1S/C19H29N2/c1-3-4-14-20-15-21(19-13-9-8-12-18(19)20)16(2)17-10-6-5-7-11-17/h8-9,12-13,15-17H,3-7,10-11,14H2,1-2H3/q+1/t16-/m0/s1