(phenylmethyl) 12-oxidanyloctadecanoate

Systemtic Name: (phenylmethyl) 12-oxidanyloctadecanoate Openeye Name: benzyl 12-hydroxyoctadecanoate CAS Name: 12-hydroxyoctadecanoic acid (phenylmethyl) ester IUPAC Name: benzyl 12-hydroxyoctadecanoate Traditional Name: 12-hydroxystearic acid benzyl ester Formula: C25H42O3 MolecularWeight: 390.59918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCCCCCCCCC(=O)OCC1=CC=CC=C1)O

Isomeric SMILES

CCCCCCC(CCCCCCCCCCC(=O)OCC1=CC=CC=C1)O

InChI

InChI=1S/C25H42O3/c1-2-3-4-14-19-24(26)20-15-9-7-5-6-8-10-16-21-25(27)28-22-23-17-12-11-13-18-23/h11-13,17-18,24,26H,2-10,14-16,19-22H2,1H3