7-(5-cyanopyridin-3-yl)-4,7-diazabicyclo[4.2.0]octane-4-carboxylate

Systemtic Name: 7-(5-cyanopyridin-3-yl)-4,7-diazabicyclo[4.2.0]octane-4-carboxylate Openeye Name: 7-(5-cyano-3-pyridyl)-4,7-diazabicyclo[4.2.0]octane-4-carboxylate CAS Name: 7-(5-cyano-3-pyridinyl)-4,7-diazabicyclo[4.2.0]octane-4-carboxylate IUPAC Name: 7-(5-cyanopyridin-3-yl)-4,7-diazabicyclo[4.2.0]octane-4-carboxylate Traditional Name: 7-(5-cyano-3-pyridyl)-4,7-diazabicyclo[4.2.0]octane-4-carboxylate Formula: C13H13N4O2- MolecularWeight: 257.26792

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2C1CN2C3=CN=CC(=C3)C#N)C(=O)[O-]

Isomeric SMILES

C1CN(CC2C1CN2C3=CN=CC(=C3)C#N)C(=O)[O-]

InChI

InChI=1S/C13H14N4O2/c14-4-9-3-11(6-15-5-9)17-7-10-1-2-16(13(18)19)8-12(10)17/h3,5-6,10,12H,1-2,7-8H2,(H,18,19)/p-1