tert-butyl (4S)-2,2-dimethyl-4-[(1R)-3-(4-methylphenyl)sulfonyl-1-oxidanyl-but-3-enyl]-1,3-oxazolidine-3-carboxylate

Systemtic Name: tert-butyl (4S)-2,2-dimethyl-4-[(1R)-3-(4-methylphenyl)sulfonyl-1-oxidanyl-but-3-enyl]-1,3-oxazolidine-3-carboxylate Openeye Name: tert-butyl (4S)-4-[(1R)-1-hydroxy-3-(p-tolylsulfonyl)but-3-enyl]-2,2-dimethyl-oxazolidine-3-carboxylate CAS Name: (4S)-4-[(1R)-1-hydroxy-3-(4-methylphenyl)sulfonylbut-3-enyl]-2,2-dimethyl-3-oxazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (4S)-4-[(1R)-1-hydroxy-3-(4-methylphenyl)sulfonylbut-3-enyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate Traditional Name: (4S)-4-[(1R)-1-hydroxy-3-tosyl-but-3-enyl]-2,2-dimethyl-oxazolidine-3-carboxylic acid tert-butyl ester Formula: C21H31NO6S MolecularWeight: 425.53894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=C)CC(C2COC(N2C(=O)OC(C)(C)C)(C)C)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(=C)C[C@H]([C@@H]2COC(N2C(=O)OC(C)(C)C)(C)C)O

InChI

InChI=1S/C21H31NO6S/c1-14-8-10-16(11-9-14)29(25,26)15(2)12-18(23)17-13-27-21(6,7)22(17)19(24)28-20(3,4)5/h8-11,17-18,23H,2,12-13H2,1,3-7H3/t17-,18+/m0/s1