tert-butyl (3R)-2-[(4-bromophenyl)methyl]-1,1-bis(oxidanylidene)-1,2-thiazinane-3-carboxylate

Systemtic Name: tert-butyl (3R)-2-[(4-bromophenyl)methyl]-1,1-bis(oxidanylidene)-1,2-thiazinane-3-carboxylate Openeye Name: tert-butyl (3R)-2-[(4-bromophenyl)methyl]-1,1-dioxo-thiazinane-3-carboxylate CAS Name: (3R)-2-[(4-bromophenyl)methyl]-1,1-dioxo-3-thiazinanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-2-[(4-bromophenyl)methyl]-1,1-dioxothiazinane-3-carboxylate Traditional Name: (3R)-2-(4-bromobenzyl)-1,1-diketo-thiazinane-3-carboxylic acid tert-butyl ester Formula: C16H22BrNO4S MolecularWeight: 404.31918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CCCS(=O)(=O)N1CC2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)(C)OC(=O)[C@H]1CCCS(=O)(=O)N1CC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H22BrNO4S/c1-16(2,3)22-15(19)14-5-4-10-23(20,21)18(14)11-12-6-8-13(17)9-7-12/h6-9,14H,4-5,10-11H2,1-3H3/t14-/m1/s1