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

Systemtic Name: 8-but-2-ynyl-3-(5-chloranylpyridin-3-yl)-8-azabicyclo[3.2.1]oct-6-ene-3-carbonitrile Openeye Name: 8-but-2-ynyl-3-(5-chloro-3-pyridyl)-8-azabicyclo[3.2.1]oct-6-ene-3-carbonitrile CAS Name: 8-but-2-ynyl-3-(5-chloro-3-pyridinyl)-8-azabicyclo[3.2.1]oct-6-ene-3-carbonitrile IUPAC Name: 8-but-2-ynyl-3-(5-chloropyridin-3-yl)-8-azabicyclo[3.2.1]oct-6-ene-3-carbonitrile Traditional Name: 8-but-2-ynyl-3-(5-chloro-3-pyridyl)-8-azabicyclo[3.2.1]oct-6-ene-3-carbonitrile Formula: C17H16ClN3 MolecularWeight: 297.78204

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCN1C2CC(CC1C=C2)(C#N)C3=CC(=CN=C3)Cl

Isomeric SMILES

CC#CCN1C2CC(CC1C=C2)(C#N)C3=CC(=CN=C3)Cl

InChI

InChI=1S/C17H16ClN3/c1-2-3-6-21-15-4-5-16(21)9-17(8-15,12-19)13-7-14(18)11-20-10-13/h4-5,7,10-11,15-16H,6,8-9H2,1H3