[(1R)-2-methoxy-2-oxidanylidene-1-phenyl-ethyl] 2,4,6,6,6-pentadeuteriohexanoate

Systemtic Name: [(1R)-2-methoxy-2-oxidanylidene-1-phenyl-ethyl] 2,4,6,6,6-pentadeuteriohexanoate Openeye Name: [(1R)-2-methoxy-2-oxo-1-phenyl-ethyl] 2,4,6,6,6-pentadeuteriohexanoate CAS Name: 2,4,6,6,6-pentadeuteriohexanoic acid [(1R)-2-methoxy-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-methoxy-2-oxo-1-phenylethyl] 2,4,6,6,6-pentadeuteriohexanoate Traditional Name: 2,4,6,6,6-pentadeuteriohexanoic acid [(1R)-2-keto-2-methoxy-1-phenyl-ethyl] ester Formula: C15H20O4 MolecularWeight: 269.347709

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20O4/c1-3-4-6-11-13(16)19-14(15(17)18-2)12-9-7-5-8-10-12/h5,7-10,14H,3-4,6,11H2,1-2H3/t14-/m1/s1/i1D3,4D,11D/t4?,11?,14-