(phenylmethyl) (2R,3S)-2-bromanyl-4-methyl-3-oxidanyl-pentanoate

Systemtic Name: (phenylmethyl) (2R,3S)-2-bromanyl-4-methyl-3-oxidanyl-pentanoate Openeye Name: benzyl (2R,3S)-2-bromo-3-hydroxy-4-methyl-pentanoate CAS Name: (2R,3S)-2-bromo-3-hydroxy-4-methylpentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2R,3S)-2-bromo-3-hydroxy-4-methylpentanoate Traditional Name: (2R,3S)-2-bromo-3-hydroxy-4-methyl-valeric acid benzyl ester Formula: C13H17BrO3 MolecularWeight: 301.17628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17BrO3/c1-9(2)12(15)11(14)13(16)17-8-10-6-4-3-5-7-10/h3-7,9,11-12,15H,8H2,1-2H3/t11-,12+/m1/s1