3-(2-cyclohexylethyl)-2-(phenoxymethyl)-1H-benzimidazol-3-ium

Systemtic Name: 3-(2-cyclohexylethyl)-2-(phenoxymethyl)-1H-benzimidazol-3-ium Openeye Name: 3-(2-cyclohexylethyl)-2-(phenoxymethyl)-1H-benzimidazol-3-ium CAS Name: 3-(2-cyclohexylethyl)-2-(phenoxymethyl)-1H-benzimidazol-3-ium IUPAC Name: 3-(2-cyclohexylethyl)-2-(phenoxymethyl)-1H-benzimidazol-3-ium Traditional Name: 3-(2-cyclohexylethyl)-2-(phenoxymethyl)-1H-benzimidazol-3-ium Formula: C22H27N2O+ MolecularWeight: 335.46258

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC[N+]2=C(NC3=CC=CC=C32)COC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)CC[N+]2=C(NC3=CC=CC=C32)COC4=CC=CC=C4

InChI

InChI=1S/C22H26N2O/c1-3-9-18(10-4-1)15-16-24-21-14-8-7-13-20(21)23-22(24)17-25-19-11-5-2-6-12-19/h2,5-8,11-14,18H,1,3-4,9-10,15-17H2/p+1