tert-butyl (3S,4S)-3-bromanyl-2-oxidanylidene-4-phenyl-3-(phenylsulfonyl)azetidine-1-carboxylate

Systemtic Name: tert-butyl (3S,4S)-3-bromanyl-2-oxidanylidene-4-phenyl-3-(phenylsulfonyl)azetidine-1-carboxylate Openeye Name: tert-butyl (3S,4S)-3-(benzenesulfonyl)-3-bromo-2-oxo-4-phenyl-azetidine-1-carboxylate CAS Name: (3S,4S)-3-(benzenesulfonyl)-3-bromo-2-oxo-4-phenyl-1-azetidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3S,4S)-3-(benzenesulfonyl)-3-bromo-2-oxo-4-phenylazetidine-1-carboxylate Traditional Name: (3S,4S)-3-besyl-3-bromo-2-keto-4-phenyl-azetidine-1-carboxylic acid tert-butyl ester Formula: C20H20BrNO5S MolecularWeight: 466.3455

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(C(C1=O)(S(=O)(=O)C2=CC=CC=C2)Br)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@H]([C@](C1=O)(S(=O)(=O)C2=CC=CC=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C20H20BrNO5S/c1-19(2,3)27-18(24)22-16(14-10-6-4-7-11-14)20(21,17(22)23)28(25,26)15-12-8-5-9-13-15/h4-13,16H,1-3H3/t16-,20+/m0/s1