1-(2-heptadecyl-4,5-dihydroimidazol-1-yl)ethanamine; octadecanoic acid

Systemtic Name: 1-(2-heptadecyl-4,5-dihydroimidazol-1-yl)ethanamine; octadecanoic acid Openeye Name: 1-(2-heptadecyl-4,5-dihydroimidazol-1-yl)ethanamine; stearic acid CAS Name: 1-(2-heptadecyl-4,5-dihydroimidazol-1-yl)ethanamine; octadecanoic acid IUPAC Name: 1-(2-heptadecyl-4,5-dihydroimidazol-1-yl)ethanamine; octadecanoic acid Traditional Name: 1-(2-heptadecyl-2-imidazolin-1-yl)ethylamine; stearic acid Formula: C40H81N3O2 MolecularWeight: 636.09004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=NCCN1C(C)N.CCCCCCCCCCCCCCCCCC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=NCCN1C(C)N.CCCCCCCCCCCCCCCCCC(=O)O

InChI

InChI=1S/C22H45N3.C18H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-24-19-20-25(22)21(2)23;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h21H,3-20,23H2,1-2H3;2-17H2,1H3,(H,19,20)