tert-butyl (1S,4S)-8-bromanyl-5,5-dimethoxy-6-oxidanylidene-2-oxa-3-azabicyclo[2.2.2]oct-7-ene-3-carboxylate

Systemtic Name: tert-butyl (1S,4S)-8-bromanyl-5,5-dimethoxy-6-oxidanylidene-2-oxa-3-azabicyclo[2.2.2]oct-7-ene-3-carboxylate Openeye Name: tert-butyl (1S,4S)-8-bromo-5,5-dimethoxy-6-oxo-2-oxa-3-azabicyclo[2.2.2]oct-7-ene-3-carboxylate CAS Name: (1S,4S)-8-bromo-5,5-dimethoxy-6-oxo-2-oxa-3-azabicyclo[2.2.2]oct-7-ene-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1S,4S)-8-bromo-5,5-dimethoxy-6-oxo-2-oxa-3-azabicyclo[2.2.2]oct-7-ene-3-carboxylate Traditional Name: (1S,4S)-8-bromo-6-keto-5,5-dimethoxy-2-oxa-3-azabicyclo[2.2.2]oct-7-ene-3-carboxylic acid tert-butyl ester Formula: C13H18BrNO6 MolecularWeight: 364.18912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2C(=CC(O1)C(=O)C2(OC)OC)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@@H]2C(=C[C@H](O1)C(=O)C2(OC)OC)Br

InChI

InChI=1S/C13H18BrNO6/c1-12(2,3)20-11(17)15-9-7(14)6-8(21-15)10(16)13(9,18-4)19-5/h6,8-9H,1-5H3/t8-,9+/m0/s1