3-(5-chloranylpyridin-3-yl)-8-(2-cyanoethyl)-8-azabicyclo[3.2.1]oct-6-ene-3-carbonitrile

Systemtic Name: 3-(5-chloranylpyridin-3-yl)-8-(2-cyanoethyl)-8-azabicyclo[3.2.1]oct-6-ene-3-carbonitrile Openeye Name: 3-(5-chloro-3-pyridyl)-8-(2-cyanoethyl)-8-azabicyclo[3.2.1]oct-6-ene-3-carbonitrile CAS Name: 3-(5-chloro-3-pyridinyl)-8-(2-cyanoethyl)-8-azabicyclo[3.2.1]oct-6-ene-3-carbonitrile IUPAC Name: 3-(5-chloropyridin-3-yl)-8-(2-cyanoethyl)-8-azabicyclo[3.2.1]oct-6-ene-3-carbonitrile Traditional Name: 3-(5-chloro-3-pyridyl)-8-(2-cyanoethyl)-8-azabicyclo[3.2.1]oct-6-ene-3-carbonitrile Formula: C16H15ClN4 MolecularWeight: 298.7701

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C=CC(N2CCC#N)CC1(C#N)C3=CC(=CN=C3)Cl

Isomeric SMILES

C1C2C=CC(N2CCC#N)CC1(C#N)C3=CC(=CN=C3)Cl

InChI

InChI=1S/C16H15ClN4/c17-13-6-12(9-20-10-13)16(11-19)7-14-2-3-15(8-16)21(14)5-1-4-18/h2-3,6,9-10,14-15H,1,5,7-8H2