magnesium (9E,12E,15E)-2-ethyloctadeca-9,12,15-trienoic acid

Systemtic Name: magnesium (9E,12E,15E)-2-ethyloctadeca-9,12,15-trienoic acid Openeye Name: magnesium (9E,12E,15E)-2-ethyloctadeca-9,12,15-trienoic acid CAS Name: magnesium (9E,12E,15E)-2-ethyloctadeca-9,12,15-trienoic acid IUPAC Name: magnesium (9E,12E,15E)-2-ethyloctadeca-9,12,15-trienoic acid Traditional Name: magnesium (9E,12E,15E)-2-ethyloctadeca-9,12,15-trienoic acid Formula: C20H34MgO2+2 MolecularWeight: 330.78776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC=CCC=CCC=CCCCCCCC(CC)C(=O)O.[Mg+2]

Isomeric SMILES

CC/C=C/C/C=C/C/C=C/CCCCCCC(CC)C(=O)O.[Mg+2]

InChI

InChI=1S/C20H34O2.Mg/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(4-2)20(21)22;/h5-6,8-9,11-12,19H,3-4,7,10,13-18H2,1-2H3,(H,21,22);/q;+2/b6-5+,9-8+,12-11+;