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

Systemtic Name: (phenylmethyl) (2R,3S)-2-methyl-3-oxidanyl-heptanoate Openeye Name: benzyl (2R,3S)-3-hydroxy-2-methyl-heptanoate CAS Name: (2R,3S)-3-hydroxy-2-methylheptanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2R,3S)-3-hydroxy-2-methylheptanoate Traditional Name: (2R,3S)-3-hydroxy-2-methyl-enanthic acid benzyl ester Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22O3/c1-3-4-10-14(16)12(2)15(17)18-11-13-8-6-5-7-9-13/h5-9,12,14,16H,3-4,10-11H2,1-2H3/t12-,14+/m1/s1