[(1R,2R)-1-[(4R)-5,5-dideuterio-2-oxidanylidene-1,3-oxazolidin-4-yl]-2-phenylmethoxy-hexadecyl] benzoate

Systemtic Name: [(1R,2R)-1-[(4R)-5,5-dideuterio-2-oxidanylidene-1,3-oxazolidin-4-yl]-2-phenylmethoxy-hexadecyl] benzoate Openeye Name: [(1R,2R)-2-benzyloxy-1-[(4R)-5,5-dideuterio-2-oxo-oxazolidin-4-yl]hexadecyl] benzoate CAS Name: benzoic acid [(1R,2R)-1-[(4R)-5,5-dideuterio-2-oxo-4-oxazolidinyl]-2-phenylmethoxyhexadecyl] ester IUPAC Name: [(1R,2R)-1-[(4R)-5,5-dideuterio-2-oxo-1,3-oxazolidin-4-yl]-2-phenylmethoxyhexadecyl] benzoate Traditional Name: benzoic acid [(1R,2R)-2-benzoxy-1-[(4R)-5,5-dideuterio-2-keto-oxazolidin-4-yl]hexadecyl] ester Formula: C33H47NO5 MolecularWeight: 541.727613

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C(C1COC(=O)N1)OC(=O)C2=CC=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

[2H][13C]1([13C@H](NC(=O)O1)[C@@H]([C@@H](CCCCCCCCCCCCCC)OCC2=CC=CC=C2)OC(=O)C3=CC=CC=C3)[2H]

InChI

InChI=1S/C33H47NO5/c1-2-3-4-5-6-7-8-9-10-11-12-19-24-30(37-25-27-20-15-13-16-21-27)31(29-26-38-33(36)34-29)39-32(35)28-22-17-14-18-23-28/h13-18,20-23,29-31H,2-12,19,24-26H2,1H3,(H,34,36)/t29-,30+,31-/m0/s1/i26+1D2,29+1