tert-butyl 6-cyano-3-azabicyclo[3.2.0]hepta-1,4-diene-3-carboxylate

Systemtic Name: tert-butyl 6-cyano-3-azabicyclo[3.2.0]hepta-1,4-diene-3-carboxylate Openeye Name: tert-butyl 6-cyano-3-azabicyclo[3.2.0]hepta-1,4-diene-3-carboxylate CAS Name: 6-cyano-3-azabicyclo[3.2.0]hepta-1,4-diene-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-cyano-3-azabicyclo[3.2.0]hepta-1,4-diene-3-carboxylate Traditional Name: 6-cyano-3-azabicyclo[3.2.0]hepta-1,4-diene-3-carboxylic acid tert-butyl ester Formula: C12H14N2O2 MolecularWeight: 218.25176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C2CC(C2=C1)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C2CC(C2=C1)C#N

InChI

InChI=1S/C12H14N2O2/c1-12(2,3)16-11(15)14-6-9-4-8(5-13)10(9)7-14/h6-8H,4H2,1-3H3