1-heptyl-3-(4-phenylbutyl)imidazol-1-ium

Systemtic Name: 1-heptyl-3-(4-phenylbutyl)imidazol-1-ium Openeye Name: 1-heptyl-3-(4-phenylbutyl)imidazol-1-ium CAS Name: 1-heptyl-3-(4-phenylbutyl)imidazol-1-ium IUPAC Name: 1-heptyl-3-(4-phenylbutyl)imidazol-1-ium Traditional Name: 1-heptyl-3-(4-phenylbutyl)imidazol-1-ium Formula: C20H31N2+ MolecularWeight: 299.47354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC[N+]1=CN(C=C1)CCCCC2=CC=CC=C2

Isomeric SMILES

CCCCCCC[N+]1=CN(C=C1)CCCCC2=CC=CC=C2

InChI

InChI=1S/C20H31N2/c1-2-3-4-5-10-15-21-17-18-22(19-21)16-11-9-14-20-12-7-6-8-13-20/h6-8,12-13,17-19H,2-5,9-11,14-16H2,1H3/q+1