[2-(dioxidanyl)-3-phosphonooxy-propyl] (E)-octadec-9-enoate

Systemtic Name: [2-(dioxidanyl)-3-phosphonooxy-propyl] (E)-octadec-9-enoate Openeye Name: (2-hydroperoxy-3-phosphonooxy-propyl) (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid (2-hydroperoxy-3-phosphonooxypropyl) ester IUPAC Name: (2-hydroperoxy-3-phosphonooxypropyl) (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid (2-hydroperoxy-3-phosphonooxy-propyl) ester Formula: C21H41O8P MolecularWeight: 452.519201

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)(O)O)OO

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OCC(COP(=O)(O)O)OO

InChI

InChI=1S/C21H41O8P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(22)27-18-20(29-23)19-28-30(24,25)26/h9-10,20,23H,2-8,11-19H2,1H3,(H2,24,25,26)/b10-9+