2-[2-(2-cyclohexylethyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]ethanenitrile

Systemtic Name: 2-[2-(2-cyclohexylethyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]ethanenitrile Openeye Name: 2-[2-(2-cyclohexylethyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]acetonitrile CAS Name: 2-[2-(2-cyclohexylethyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]acetonitrile IUPAC Name: 2-[2-(2-cyclohexylethyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]acetonitrile Traditional Name: 2-[2-(2-cyclohexylethyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]acetonitrile Formula: C19H26N3+ MolecularWeight: 296.42984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)[N+](=C(N2)CCC3CCCCC3)CC#N

Isomeric SMILES

CC1=CC2=C(C=C1C)[N+](=C(N2)CCC3CCCCC3)CC#N

InChI

InChI=1S/C19H25N3/c1-14-12-17-18(13-15(14)2)22(11-10-20)19(21-17)9-8-16-6-4-3-5-7-16/h12-13,16H,3-9,11H2,1-2H3/p+1