methyl (2S,3S)-4-methyl-3-oxidanyl-2-phenyl-pentanoate

Systemtic Name: methyl (2S,3S)-4-methyl-3-oxidanyl-2-phenyl-pentanoate Openeye Name: methyl (2S,3S)-3-hydroxy-4-methyl-2-phenyl-pentanoate CAS Name: (2S,3S)-3-hydroxy-4-methyl-2-phenylpentanoic acid methyl ester IUPAC Name: methyl (2S,3S)-3-hydroxy-4-methyl-2-phenylpentanoate Traditional Name: (2S,3S)-3-hydroxy-4-methyl-2-phenyl-valeric acid methyl ester Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C1=CC=CC=C1)C(=O)OC)O

Isomeric SMILES

CC(C)[C@@H]([C@H](C1=CC=CC=C1)C(=O)OC)O

InChI

InChI=1S/C13H18O3/c1-9(2)12(14)11(13(15)16-3)10-7-5-4-6-8-10/h4-9,11-12,14H,1-3H3/t11-,12-/m0/s1