1,2-dimethyl-3-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-1-ium

Systemtic Name: 1,2-dimethyl-3-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-1-ium Openeye Name: 3-benzyl-1,2-dimethyl-5-(trifluoromethyl)benzimidazol-1-ium CAS Name: 1,2-dimethyl-3-(phenylmethyl)-5-(trifluoromethyl)benzimidazol-1-ium IUPAC Name: 3-benzyl-1,2-dimethyl-5-(trifluoromethyl)benzimidazol-1-ium Traditional Name: 3-benzyl-1,2-dimethyl-5-(trifluoromethyl)benzimidazol-1-ium Formula: C17H16F3N2+ MolecularWeight: 305.31755

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=C(N1CC3=CC=CC=C3)C=C(C=C2)C(F)(F)F)C

Isomeric SMILES

CC1=[N+](C2=C(N1CC3=CC=CC=C3)C=C(C=C2)C(F)(F)F)C

InChI

InChI=1S/C17H16F3N2/c1-12-21(2)15-9-8-14(17(18,19)20)10-16(15)22(12)11-13-6-4-3-5-7-13/h3-10H,11H2,1-2H3/q+1