(9E,12E)-11-(dioxidanyl)octadeca-9,12-dienoate

Systemtic Name: (9E,12E)-11-(dioxidanyl)octadeca-9,12-dienoate Openeye Name: (9E,12E)-11-hydroperoxyoctadeca-9,12-dienoate CAS Name: (9E,12E)-11-hydroperoxyoctadeca-9,12-dienoate IUPAC Name: (9E,12E)-11-hydroperoxyoctadeca-9,12-dienoate Traditional Name: (9E,12E)-11-hydroperoxyoctadeca-9,12-dienoate Formula: C18H31O4- MolecularWeight: 311.43634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CC(C=CCCCCCCCC(=O)[O-])OO

Isomeric SMILES

CCCCC/C=C/C(/C=C/CCCCCCCC(=O)[O-])OO

InChI

InChI=1S/C18H32O4/c1-2-3-4-8-11-14-17(22-21)15-12-9-6-5-7-10-13-16-18(19)20/h11-12,14-15,17,21H,2-10,13,16H2,1H3,(H,19,20)/p-1/b14-11+,15-12+