tert-butyl (4S)-2,2-dimethyl-4-[(1S,2R)-2-oxidanyl-1-phenylmethoxy-hexadecyl]-1,3-oxazolidine-3-carboxylate

Systemtic Name: tert-butyl (4S)-2,2-dimethyl-4-[(1S,2R)-2-oxidanyl-1-phenylmethoxy-hexadecyl]-1,3-oxazolidine-3-carboxylate Openeye Name: tert-butyl (4S)-4-[(1S,2R)-1-benzyloxy-2-hydroxy-hexadecyl]-2,2-dimethyl-oxazolidine-3-carboxylate CAS Name: (4S)-4-[(1S,2R)-2-hydroxy-1-phenylmethoxyhexadecyl]-2,2-dimethyl-3-oxazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (4S)-4-[(1S,2R)-2-hydroxy-1-phenylmethoxyhexadecyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate Traditional Name: (4S)-4-[(1S,2R)-1-benzoxy-2-hydroxy-hexadecyl]-2,2-dimethyl-oxazolidine-3-carboxylic acid tert-butyl ester Formula: C33H57NO5 MolecularWeight: 547.80938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C(C1COC(N1C(=O)OC(C)(C)C)(C)C)OCC2=CC=CC=C2)O

Isomeric SMILES

CCCCCCCCCCCCCC[C@H]([C@H]([C@@H]1COC(N1C(=O)OC(C)(C)C)(C)C)OCC2=CC=CC=C2)O

InChI

InChI=1S/C33H57NO5/c1-7-8-9-10-11-12-13-14-15-16-17-21-24-29(35)30(37-25-27-22-19-18-20-23-27)28-26-38-33(5,6)34(28)31(36)39-32(2,3)4/h18-20,22-23,28-30,35H,7-17,21,24-26H2,1-6H3/t28-,29+,30-/m0/s1