(E)-2-(dioxidanyl)-13-oxidanyl-12-oxidanylidene-octadec-10-enoic acid

Systemtic Name: (E)-2-(dioxidanyl)-13-oxidanyl-12-oxidanylidene-octadec-10-enoic acid Openeye Name: (E)-2-hydroperoxy-13-hydroxy-12-oxo-octadec-10-enoic acid CAS Name: (E)-2-hydroperoxy-13-hydroxy-12-oxo-10-octadecenoic acid IUPAC Name: (E)-2-hydroperoxy-13-hydroxy-12-oxooctadec-10-enoic acid Traditional Name: (E)-2-hydroperoxy-13-hydroxy-12-keto-octadec-10-enoic acid Formula: C18H32O6 MolecularWeight: 344.44308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(=O)C=CCCCCCCCC(C(=O)O)OO)O

Isomeric SMILES

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

InChI

InChI=1S/C18H32O6/c1-2-3-9-12-15(19)16(20)13-10-7-5-4-6-8-11-14-17(24-23)18(21)22/h10,13,15,17,19,23H,2-9,11-12,14H2,1H3,(H,21,22)/b13-10+