2-heptan-4-yl-1,1-dimethyl-4,5-dihydroimidazol-1-ium

Systemtic Name: 2-heptan-4-yl-1,1-dimethyl-4,5-dihydroimidazol-1-ium Openeye Name: 1,1-dimethyl-2-(1-propylbutyl)-4,5-dihydroimidazol-1-ium CAS Name: 2-heptan-4-yl-1,1-dimethyl-4,5-dihydroimidazol-1-ium IUPAC Name: 2-heptan-4-yl-1,1-dimethyl-4,5-dihydroimidazol-1-ium Traditional Name: 1,1-dimethyl-2-(1-propylbutyl)-2-imidazolin-1-ium Formula: C12H25N2+ MolecularWeight: 197.3403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C1=NCC[N+]1(C)C

Isomeric SMILES

CCCC(CCC)C1=NCC[N+]1(C)C

InChI

InChI=1S/C12H25N2/c1-5-7-11(8-6-2)12-13-9-10-14(12,3)4/h11H,5-10H2,1-4H3/q+1