methyl (2S,3S)-2,3-dideuterio-3-phenyl-propanoate

Systemtic Name: methyl (2S,3S)-2,3-dideuterio-3-phenyl-propanoate Openeye Name: methyl (2S,3S)-2,3-dideuterio-3-phenyl-propanoate CAS Name: (2S,3S)-2,3-dideuterio-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S,3S)-2,3-dideuterio-3-phenylpropanoate Traditional Name: (2S,3S)-2,3-dideuterio-3-phenyl-propionic acid methyl ester Formula: C10H12O2 MolecularWeight: 166.213404

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=CC=C1

Isomeric SMILES

[H][C@@]([2H])(C1=CC=CC=C1)[C@]([H])([2H])C(=O)OC

InChI

InChI=1S/C10H12O2/c1-12-10(11)8-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3/i7D,8D/t7-,8-/m0/s1