(phenylmethyl) (2S,3R)-2-methyl-3-oxidanyl-decanoate

Systemtic Name: (phenylmethyl) (2S,3R)-2-methyl-3-oxidanyl-decanoate Openeye Name: benzyl (2S,3R)-3-hydroxy-2-methyl-decanoate CAS Name: (2S,3R)-3-hydroxy-2-methyldecanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,3R)-3-hydroxy-2-methyldecanoate Traditional Name: (2S,3R)-3-hydroxy-2-methyl-capric acid benzyl ester Formula: C18H28O3 MolecularWeight: 292.41312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C(C)C(=O)OCC1=CC=CC=C1)O

Isomeric SMILES

CCCCCCC[C@H]([C@H](C)C(=O)OCC1=CC=CC=C1)O

InChI

InChI=1S/C18H28O3/c1-3-4-5-6-10-13-17(19)15(2)18(20)21-14-16-11-8-7-9-12-16/h7-9,11-12,15,17,19H,3-6,10,13-14H2,1-2H3/t15-,17+/m0/s1