2-(3-butyl-2-methyl-benzimidazol-1-ium-1-yl)-1-phenyl-ethanone

Systemtic Name: 2-(3-butyl-2-methyl-benzimidazol-1-ium-1-yl)-1-phenyl-ethanone Openeye Name: 2-(3-butyl-2-methyl-benzimidazol-1-ium-1-yl)-1-phenyl-ethanone CAS Name: 2-(3-butyl-2-methyl-1-benzimidazol-1-iumyl)-1-phenylethanone IUPAC Name: 2-(3-butyl-2-methylbenzimidazol-1-ium-1-yl)-1-phenylethanone Traditional Name: 2-(3-butyl-2-methyl-benzimidazol-1-ium-1-yl)-1-phenyl-ethanone Formula: C20H23N2O+ MolecularWeight: 307.40942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=[N+](C2=CC=CC=C21)CC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CCCCN1C(=[N+](C2=CC=CC=C21)CC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C20H23N2O/c1-3-4-14-21-16(2)22(19-13-9-8-12-18(19)21)15-20(23)17-10-6-5-7-11-17/h5-13H,3-4,14-15H2,1-2H3/q+1