methyl (2R,3R)-3-methyl-2-oxidanyl-5-oxidanylidene-5-phenyl-pentanoate

Systemtic Name: methyl (2R,3R)-3-methyl-2-oxidanyl-5-oxidanylidene-5-phenyl-pentanoate Openeye Name: methyl (2R,3R)-2-hydroxy-3-methyl-5-oxo-5-phenyl-pentanoate CAS Name: (2R,3R)-2-hydroxy-3-methyl-5-oxo-5-phenylpentanoic acid methyl ester IUPAC Name: methyl (2R,3R)-2-hydroxy-3-methyl-5-oxo-5-phenylpentanoate Traditional Name: (2R,3R)-2-hydroxy-5-keto-3-methyl-5-phenyl-valeric acid methyl ester Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O4/c1-9(12(15)13(16)17-2)8-11(14)10-6-4-3-5-7-10/h3-7,9,12,15H,8H2,1-2H3/t9-,12-/m1/s1