[2-(hydroxymethyl)-2-(nonanoyloxymethyl)butyl] (Z)-octadec-9-enoate

Systemtic Name: [2-(hydroxymethyl)-2-(nonanoyloxymethyl)butyl] (Z)-octadec-9-enoate Openeye Name: [2-(hydroxymethyl)-2-(nonanoyloxymethyl)butyl] (Z)-octadec-9-enoate CAS Name: (Z)-9-octadecenoic acid [2-(hydroxymethyl)-2-(1-oxononoxymethyl)butyl] ester IUPAC Name: [2-(hydroxymethyl)-2-(nonanoyloxymethyl)butyl] (Z)-octadec-9-enoate Traditional Name: (Z)-octadec-9-enoic acid [2-methylol-2-(pelargonyloxymethyl)butyl] ester Formula: C33H62O5 MolecularWeight: 538.84238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OCC(CC)(CO)COC(=O)CCCCCCCC

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCC(=O)OCC(CC)(CO)COC(=O)CCCCCCCC

InChI

InChI=1S/C33H62O5/c1-4-7-9-11-13-14-15-16-17-18-19-20-21-23-25-27-32(36)38-30-33(6-3,28-34)29-37-31(35)26-24-22-12-10-8-5-2/h16-17,34H,4-15,18-30H2,1-3H3/b17-16-