[2-(hydroxymethyl)-2-methyl-3-oxidanyl-propyl] (E)-octadec-9-enoate

Systemtic Name: [2-(hydroxymethyl)-2-methyl-3-oxidanyl-propyl] (E)-octadec-9-enoate Openeye Name: [3-hydroxy-2-(hydroxymethyl)-2-methyl-propyl] (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid [3-hydroxy-2-(hydroxymethyl)-2-methylpropyl] ester IUPAC Name: [3-hydroxy-2-(hydroxymethyl)-2-methylpropyl] (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid (3-hydroxy-2-methyl-2-methylol-propyl) ester Formula: C23H44O4 MolecularWeight: 384.59306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OCC(C)(CO)CO

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OCC(C)(CO)CO

InChI

InChI=1S/C23H44O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(26)27-21-23(2,19-24)20-25/h10-11,24-25H,3-9,12-21H2,1-2H3/b11-10+