(E)-13-(dioxidanyl)octadec-9-enoic acid

Systemtic Name: (E)-13-(dioxidanyl)octadec-9-enoic acid Openeye Name: (E)-13-hydroperoxyoctadec-9-enoic acid CAS Name: (E)-13-hydroperoxy-9-octadecenoic acid IUPAC Name: (E)-13-hydroperoxyoctadec-9-enoic acid Traditional Name: (E)-13-hydroperoxyoctadec-9-enoic acid Formula: C18H34O4 MolecularWeight: 314.46016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H34O4/c1-2-3-11-14-17(22-21)15-12-9-7-5-4-6-8-10-13-16-18(19)20/h7,9,17,21H,2-6,8,10-16H2,1H3,(H,19,20)/b9-7+