(E)-octadec-9-enal; octanoyl decaneperoxoate; propane-1,2,3-triol

Systemtic Name: (E)-octadec-9-enal; octanoyl decaneperoxoate; propane-1,2,3-triol Openeye Name: glycerol; (E)-octadec-9-enal; octanoyl decaneperoxoate CAS Name: decaneperoxoic acid 1-oxooctyl ester; (E)-9-octadecenal; propane-1,2,3-triol IUPAC Name: (E)-octadec-9-enal; octanoyl decaneperoxoate; propane-1,2,3-triol Traditional Name: glycerol; (E)-octadec-9-enal; peroxycapric acid caprylyl ester Formula: C39H76O8 MolecularWeight: 673.01594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OOC(=O)CCCCCCC.CCCCCCCCC=CCCCCCCCC=O.C(C(CO)O)O

Isomeric SMILES

CCCCCCCCCC(=O)OOC(=O)CCCCCCC.CCCCCCCC/C=C/CCCCCCCC=O.C(C(CO)O)O

InChI

InChI=1S/C18H34O4.C18H34O.C3H8O3/c1-3-5-7-9-10-12-14-16-18(20)22-21-17(19)15-13-11-8-6-4-2;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19;4-1-3(6)2-5/h3-16H2,1-2H3;9-10,18H,2-8,11-17H2,1H3;3-6H,1-2H2/b;10-9+;