4-[(2-cyclohexyl-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(2-cyclohexyl-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(2-cyclohexyl-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl)methyl]benzonitrile CAS Name: 4-[(2-cyclohexyl-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl)methyl]benzonitrile IUPAC Name: 4-[(2-cyclohexyl-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl)methyl]benzonitrile Traditional Name: 4-[(2-cyclohexyl-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl)methyl]benzonitrile Formula: C23H26N3+ MolecularWeight: 344.47264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)[N+](=C(N2)C3CCCCC3)CC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=CC2=C(C=C1C)[N+](=C(N2)C3CCCCC3)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H25N3/c1-16-12-21-22(13-17(16)2)26(15-19-10-8-18(14-24)9-11-19)23(25-21)20-6-4-3-5-7-20/h8-13,20H,3-7,15H2,1-2H3/p+1