[2-(hydroxymethyl)-2-methyl-3-oxidanyl-propyl] nonanoate

Systemtic Name: [2-(hydroxymethyl)-2-methyl-3-oxidanyl-propyl] nonanoate Openeye Name: [3-hydroxy-2-(hydroxymethyl)-2-methyl-propyl] nonanoate CAS Name: nonanoic acid [3-hydroxy-2-(hydroxymethyl)-2-methylpropyl] ester IUPAC Name: [3-hydroxy-2-(hydroxymethyl)-2-methylpropyl] nonanoate Traditional Name: pelargonic acid (3-hydroxy-2-methyl-2-methylol-propyl) ester Formula: C14H28O4 MolecularWeight: 260.36972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H28O4/c1-3-4-5-6-7-8-9-13(17)18-12-14(2,10-15)11-16/h15-16H,3-12H2,1-2H3