methyl (1R,5S,6R,8S)-6-bromanyl-2-oxidanylidene-3-azabicyclo[3.2.1]octane-8-carboxylate

Systemtic Name: methyl (1R,5S,6R,8S)-6-bromanyl-2-oxidanylidene-3-azabicyclo[3.2.1]octane-8-carboxylate Openeye Name: methyl (1R,5S,6R,8S)-6-bromo-2-oxo-3-azabicyclo[3.2.1]octane-8-carboxylate CAS Name: (1R,5S,6R,8S)-6-bromo-2-oxo-3-azabicyclo[3.2.1]octane-8-carboxylic acid methyl ester IUPAC Name: methyl (1R,5S,6R,8S)-6-bromo-2-oxo-3-azabicyclo[3.2.1]octane-8-carboxylate Traditional Name: (1R,5S,6R,8S)-6-bromo-2-keto-3-azabicyclo[3.2.1]octane-8-carboxylic acid methyl ester Formula: C9H12BrNO3 MolecularWeight: 262.10048

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C2CC(C1CNC2=O)Br

Isomeric SMILES

COC(=O)[C@H]1[C@H]2C[C@H]([C@@H]1CNC2=O)Br

InChI

InChI=1S/C9H12BrNO3/c1-14-9(13)7-4-2-6(10)5(7)3-11-8(4)12/h4-7H,2-3H2,1H3,(H,11,12)/t4-,5+,6-,7+/m1/s1