tert-butyl (4S)-2,2-dimethyl-4-[(E,1S)-1-oxidanylhexadec-2-enyl]-1,3-oxazolidine-3-carboxylate

Systemtic Name: tert-butyl (4S)-2,2-dimethyl-4-[(E,1S)-1-oxidanylhexadec-2-enyl]-1,3-oxazolidine-3-carboxylate Openeye Name: tert-butyl (4S)-4-[(E,1S)-1-hydroxyhexadec-2-enyl]-2,2-dimethyl-oxazolidine-3-carboxylate CAS Name: (4S)-4-[(E,1S)-1-hydroxyhexadec-2-enyl]-2,2-dimethyl-3-oxazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (4S)-4-[(E,1S)-1-hydroxyhexadec-2-enyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate Traditional Name: (4S)-4-[(E,1S)-1-hydroxyhexadec-2-enyl]-2,2-dimethyl-oxazolidine-3-carboxylic acid tert-butyl ester Formula: C26H49NO4 MolecularWeight: 439.67156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CC(C1COC(N1C(=O)OC(C)(C)C)(C)C)O

Isomeric SMILES

CCCCCCCCCCCCC/C=C/[C@@H]([C@@H]1COC(N1C(=O)OC(C)(C)C)(C)C)O

InChI

InChI=1S/C26H49NO4/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(28)22-21-30-26(5,6)27(22)24(29)31-25(2,3)4/h19-20,22-23,28H,7-18,21H2,1-6H3/b20-19+/t22-,23-/m0/s1