2-butyl-1-(2-methyl-3-phenyl-phenyl)benzimidazol-1-ium-1-carbonitrile

Systemtic Name: 2-butyl-1-(2-methyl-3-phenyl-phenyl)benzimidazol-1-ium-1-carbonitrile Openeye Name: 2-butyl-1-(2-methyl-3-phenyl-phenyl)benzimidazol-1-ium-1-carbonitrile CAS Name: 2-butyl-1-(2-methyl-3-phenylphenyl)-1-benzimidazol-1-iumcarbonitrile IUPAC Name: 2-butyl-1-(2-methyl-3-phenylphenyl)benzimidazol-1-ium-1-carbonitrile Traditional Name: 2-butyl-1-(2-methyl-3-phenyl-phenyl)benzimidazol-1-ium-1-carbonitrile Formula: C25H24N3+ MolecularWeight: 366.47816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC=C2[N+]1(C#N)C3=CC=CC(=C3C)C4=CC=CC=C4

Isomeric SMILES

CCCCC1=NC2=CC=CC=C2[N+]1(C#N)C3=CC=CC(=C3C)C4=CC=CC=C4

InChI

InChI=1S/C25H24N3/c1-3-4-17-25-27-22-14-8-9-15-24(22)28(25,18-26)23-16-10-13-21(19(23)2)20-11-6-5-7-12-20/h5-16H,3-4,17H2,1-2H3/q+1