methyl (2S)-2-oxidanyl-4-oxidanylidene-5-phenyl-pentanoate

Systemtic Name: methyl (2S)-2-oxidanyl-4-oxidanylidene-5-phenyl-pentanoate Openeye Name: methyl (2S)-2-hydroxy-4-oxo-5-phenyl-pentanoate CAS Name: (2S)-2-hydroxy-4-oxo-5-phenylpentanoic acid methyl ester IUPAC Name: methyl (2S)-2-hydroxy-4-oxo-5-phenylpentanoate Traditional Name: (2S)-2-hydroxy-4-keto-5-phenyl-valeric acid methyl ester Formula: C12H14O4 MolecularWeight: 222.23716

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(=O)CC1=CC=CC=C1)O

Isomeric SMILES

COC(=O)[C@H](CC(=O)CC1=CC=CC=C1)O

InChI

InChI=1S/C12H14O4/c1-16-12(15)11(14)8-10(13)7-9-5-3-2-4-6-9/h2-6,11,14H,7-8H2,1H3/t11-/m0/s1