diethylazanium; (9E,12E,15E)-octadeca-9,12,15-trienoate

Systemtic Name: diethylazanium; (9E,12E,15E)-octadeca-9,12,15-trienoate Openeye Name: diethylammonium; (9E,12E,15E)-octadeca-9,12,15-trienoate CAS Name: diethylammonium; (9E,12E,15E)-octadeca-9,12,15-trienoate IUPAC Name: diethylazanium; (9E,12E,15E)-octadeca-9,12,15-trienoate Traditional Name: diethylammonium; (9E,12E,15E)-octadeca-9,12,15-trienoate Formula: C22H41NO2 MolecularWeight: 351.56644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC=CCC=CCC=CCCCCCCCC(=O)[O-].CC[NH2+]CC

Isomeric SMILES

CC/C=C/C/C=C/C/C=C/CCCCCCCC(=O)[O-].CC[NH2+]CC

InChI

InChI=1S/C18H30O2.C4H11N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-3-5-4-2/h3-4,6-7,9-10H,2,5,8,11-17H2,1H3,(H,19,20);5H,3-4H2,1-2H3/b4-3+,7-6+,10-9+;