(9Z,12E,15Z)-13-(dioxidanyl)octadeca-9,12,15-trienoic acid

Systemtic Name: (9Z,12E,15Z)-13-(dioxidanyl)octadeca-9,12,15-trienoic acid Openeye Name: (9Z,12E,15Z)-13-hydroperoxyoctadeca-9,12,15-trienoic acid CAS Name: (9Z,12E,15Z)-13-hydroperoxyoctadeca-9,12,15-trienoic acid IUPAC Name: (9Z,12E,15Z)-13-hydroperoxyoctadeca-9,12,15-trienoic acid Traditional Name: (9Z,12E,15Z)-13-hydroperoxyoctadeca-9,12,15-trienoic acid Formula: C18H30O4 MolecularWeight: 310.4284

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCC(=CCC=CCCCCCCCC(=O)O)OO

Isomeric SMILES

CC/C=C\C/C(=C\C/C=C\CCCCCCCC(=O)O)/OO

InChI

InChI=1S/C18H30O4/c1-2-3-11-14-17(22-21)15-12-9-7-5-4-6-8-10-13-16-18(19)20/h3,7,9,11,15,21H,2,4-6,8,10,12-14,16H2,1H3,(H,19,20)/b9-7-,11-3-,17-15+