(phenylmethyl) (2R,3S)-2-methyl-3,6-bis(oxidanyl)hexanoate

Systemtic Name: (phenylmethyl) (2R,3S)-2-methyl-3,6-bis(oxidanyl)hexanoate Openeye Name: benzyl (2R,3S)-3,6-dihydroxy-2-methyl-hexanoate CAS Name: (2R,3S)-3,6-dihydroxy-2-methylhexanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2R,3S)-3,6-dihydroxy-2-methylhexanoate Traditional Name: (2R,3S)-3,6-dihydroxy-2-methyl-hexanoic acid benzyl ester Formula: C14H20O4 MolecularWeight: 252.3062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20O4/c1-11(13(16)8-5-9-15)14(17)18-10-12-6-3-2-4-7-12/h2-4,6-7,11,13,15-16H,5,8-10H2,1H3/t11-,13+/m1/s1