methyl (2S)-3-(4-ethylphenyl)-2-oxidanyl-propanoate

Systemtic Name: methyl (2S)-3-(4-ethylphenyl)-2-oxidanyl-propanoate Openeye Name: methyl (2S)-3-(4-ethylphenyl)-2-hydroxy-propanoate CAS Name: (2S)-3-(4-ethylphenyl)-2-hydroxypropanoic acid methyl ester IUPAC Name: methyl (2S)-3-(4-ethylphenyl)-2-hydroxypropanoate Traditional Name: (2S)-3-(4-ethylphenyl)-2-hydroxy-propionic acid methyl ester Formula: C12H16O3 MolecularWeight: 208.25364

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CC(C(=O)OC)O

Isomeric SMILES

CCC1=CC=C(C=C1)C[C@@H](C(=O)OC)O

InChI

InChI=1S/C12H16O3/c1-3-9-4-6-10(7-5-9)8-11(13)12(14)15-2/h4-7,11,13H,3,8H2,1-2H3/t11-/m0/s1