methyl (2S)-3-methyl-2-[(S)-oxidanyl(phenyl)methyl]butanoate

Systemtic Name: methyl (2S)-3-methyl-2-[(S)-oxidanyl(phenyl)methyl]butanoate Openeye Name: methyl (2S)-2-[(S)-hydroxy(phenyl)methyl]-3-methyl-butanoate CAS Name: (2S)-2-[(S)-hydroxy(phenyl)methyl]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(S)-hydroxy(phenyl)methyl]-3-methylbutanoate Traditional Name: (2S)-2-[(S)-hydroxy(phenyl)methyl]-3-methyl-butyric 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)O)C(=O)OC

Isomeric SMILES

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

InChI

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