2-[2-cyclopropyl-6-[(1-methyl-2-propyl-benzimidazol-1-ium-1-yl)methyl]benzimidazol-1-yl]ethanenitrile

Systemtic Name: 2-[2-cyclopropyl-6-[(1-methyl-2-propyl-benzimidazol-1-ium-1-yl)methyl]benzimidazol-1-yl]ethanenitrile Openeye Name: 2-[2-cyclopropyl-6-[(1-methyl-2-propyl-benzimidazol-1-ium-1-yl)methyl]benzimidazol-1-yl]acetonitrile CAS Name: 2-[2-cyclopropyl-6-[(1-methyl-2-propyl-1-benzimidazol-1-iumyl)methyl]-1-benzimidazolyl]acetonitrile IUPAC Name: 2-[2-cyclopropyl-6-[(1-methyl-2-propylbenzimidazol-1-ium-1-yl)methyl]benzimidazol-1-yl]acetonitrile Traditional Name: 2-[2-cyclopropyl-6-[(1-methyl-2-propyl-benzimidazol-1-ium-1-yl)methyl]benzimidazol-1-yl]acetonitrile Formula: C24H26N5+ MolecularWeight: 384.49674

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=CC=CC=C2[N+]1(C)CC3=CC4=C(C=C3)N=C(N4CC#N)C5CC5

Isomeric SMILES

CCCC1=NC2=CC=CC=C2[N+]1(C)CC3=CC4=C(C=C3)N=C(N4CC#N)C5CC5

InChI

InChI=1S/C24H26N5/c1-3-6-23-26-20-7-4-5-8-22(20)29(23,2)16-17-9-12-19-21(15-17)28(14-13-25)24(27-19)18-10-11-18/h4-5,7-9,12,15,18H,3,6,10-11,14,16H2,1-2H3/q+1