ethanoic acid; 1-(1-heptadecyl-4,5-dihydroimidazol-1-ium-1-yl)ethanamine

Systemtic Name: ethanoic acid; 1-(1-heptadecyl-4,5-dihydroimidazol-1-ium-1-yl)ethanamine Openeye Name: acetic acid; 1-(1-heptadecyl-4,5-dihydroimidazol-1-ium-1-yl)ethanamine CAS Name: acetic acid; 1-(1-heptadecyl-4,5-dihydroimidazol-1-ium-1-yl)ethanamine IUPAC Name: acetic acid; 1-(1-heptadecyl-4,5-dihydroimidazol-1-ium-1-yl)ethanamine Traditional Name: acetic acid; 1-(1-heptadecyl-2-imidazolin-1-ium-1-yl)ethylamine Formula: C24H50N3O2+ MolecularWeight: 412.6727

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC[N+]1(CCN=C1)C(C)N.CC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC[N+]1(CCN=C1)C(C)N.CC(=O)O

InChI

InChI=1S/C22H46N3.C2H4O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-25(22(2)23)20-18-24-21-25;1-2(3)4/h21-22H,3-20,23H2,1-2H3;1H3,(H,3,4)/q+1;