(9E,12E)-octadeca-9,12-dienoate; tris(2-hydroxyethyl)azanium

Systemtic Name: (9E,12E)-octadeca-9,12-dienoate; tris(2-hydroxyethyl)azanium Openeye Name: (9E,12E)-octadeca-9,12-dienoate; tris(2-hydroxyethyl)ammonium CAS Name: (9E,12E)-octadeca-9,12-dienoate; tris(2-hydroxyethyl)ammonium IUPAC Name: (9E,12E)-octadeca-9,12-dienoate; tris(2-hydroxyethyl)azanium Traditional Name: (9E,12E)-octadeca-9,12-dienoate; tris(2-hydroxyethyl)ammonium Formula: C24H47NO5 MolecularWeight: 429.63368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCC(=O)[O-].C(CO)[NH+](CCO)CCO

Isomeric SMILES

CCCCC/C=C/C/C=C/CCCCCCCC(=O)[O-].C(CO)[NH+](CCO)CCO

InChI

InChI=1S/C18H32O2.C6H15NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;8-4-1-7(2-5-9)3-6-10/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20);8-10H,1-6H2/b7-6+,10-9+;