(1S,4S,8S)-5-bromanyl-3-oxidanylidene-2-oxabicyclo[2.2.2]oct-5-ene-8-carbonitrile

Systemtic Name: (1S,4S,8S)-5-bromanyl-3-oxidanylidene-2-oxabicyclo[2.2.2]oct-5-ene-8-carbonitrile Openeye Name: (1S,4S,8S)-5-bromo-3-oxo-2-oxabicyclo[2.2.2]oct-5-ene-8-carbonitrile CAS Name: (1S,4S,8S)-5-bromo-3-oxo-2-oxabicyclo[2.2.2]oct-5-ene-8-carbonitrile IUPAC Name: (1S,4S,8S)-5-bromo-3-oxo-2-oxabicyclo[2.2.2]oct-5-ene-8-carbonitrile Traditional Name: (1S,4S,8S)-5-bromo-3-keto-2-oxabicyclo[2.2.2]oct-5-ene-8-carbonitrile Formula: C8H6BrNO2 MolecularWeight: 228.04274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2C=C(C(C1C#N)C(=O)O2)Br

Isomeric SMILES

C1[C@H]2C=C([C@@H]([C@H]1C#N)C(=O)O2)Br

InChI

InChI=1S/C8H6BrNO2/c9-6-2-5-1-4(3-10)7(6)8(11)12-5/h2,4-5,7H,1H2/t4-,5+,7-/m1/s1