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

Systemtic Name: [2-(hydroxymethyl)-2-methyl-3-oxidanyl-propyl] (E)-octadec-2-enoate Openeye Name: [3-hydroxy-2-(hydroxymethyl)-2-methyl-propyl] (E)-octadec-2-enoate CAS Name: (E)-2-octadecenoic acid [3-hydroxy-2-(hydroxymethyl)-2-methylpropyl] ester IUPAC Name: [3-hydroxy-2-(hydroxymethyl)-2-methylpropyl] (E)-octadec-2-enoate Traditional Name: (E)-octadec-2-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:

CCCCCCCCCCCCCCCC=CC(=O)OCC(C)(CO)CO

Isomeric SMILES

CCCCCCCCCCCCCCC/C=C/C(=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/h17-18,24-25H,3-16,19-21H2,1-2H3/b18-17+