(2E,9E,11E)-18-(dioxidanyl)octadeca-2,9,11-trienoic acid

Systemtic Name: (2E,9E,11E)-18-(dioxidanyl)octadeca-2,9,11-trienoic acid Openeye Name: (2E,9E,11E)-18-hydroperoxyoctadeca-2,9,11-trienoic acid CAS Name: (2E,9E,11E)-18-hydroperoxyoctadeca-2,9,11-trienoic acid IUPAC Name: (2E,9E,11E)-18-hydroperoxyoctadeca-2,9,11-trienoic acid Traditional Name: (2E,9E,11E)-18-hydroperoxyoctadeca-2,9,11-trienoic acid Formula: C18H30O4 MolecularWeight: 310.4284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CCCOO)CCC=CC=CCCCCCC=CC(=O)O

Isomeric SMILES

C(CCCOO)CC/C=C/C=C/CCCCC/C=C/C(=O)O

InChI

InChI=1S/C18H30O4/c19-18(20)16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17-22-21/h1-3,5,14,16,21H,4,6-13,15,17H2,(H,19,20)/b2-1+,5-3+,16-14+