tert-butyl (4S)-4-(hexadecylsulfanylmethyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylate

Systemtic Name: tert-butyl (4S)-4-(hexadecylsulfanylmethyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylate Openeye Name: tert-butyl (4S)-4-(hexadecylsulfanylmethyl)-2,2-dimethyl-oxazolidine-3-carboxylate CAS Name: (4S)-4-[(hexadecylthio)methyl]-2,2-dimethyl-3-oxazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (4S)-4-(hexadecylsulfanylmethyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylate Traditional Name: (4S)-4-[(cetylthio)methyl]-2,2-dimethyl-oxazolidine-3-carboxylic acid tert-butyl ester Formula: C27H53NO3S MolecularWeight: 471.77962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSCC1COC(N1C(=O)OC(C)(C)C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C27H53NO3S/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-32-23-24-22-30-27(5,6)28(24)25(29)31-26(2,3)4/h24H,7-23H2,1-6H3/t24-/m0/s1