5-(2,3,3a,6,7,7a-hexahydro-1H-isoindol-5-yl)-2-chloranyl-pyridine-3-carbonitrile

Systemtic Name: 5-(2,3,3a,6,7,7a-hexahydro-1H-isoindol-5-yl)-2-chloranyl-pyridine-3-carbonitrile Openeye Name: 5-(2,3,3a,6,7,7a-hexahydro-1H-isoindol-5-yl)-2-chloro-pyridine-3-carbonitrile CAS Name: 5-(2,3,3a,6,7,7a-hexahydro-1H-isoindol-5-yl)-2-chloro-3-pyridinecarbonitrile IUPAC Name: 5-(2,3,3a,6,7,7a-hexahydro-1H-isoindol-5-yl)-2-chloropyridine-3-carbonitrile Traditional Name: 5-(2,3,3a,6,7,7a-hexahydro-1H-isoindol-5-yl)-2-chloro-nicotinonitrile Formula: C14H14ClN3 MolecularWeight: 259.73406

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2C1CNC2)C3=CN=C(C(=C3)C#N)Cl

Isomeric SMILES

C1CC(=CC2C1CNC2)C3=CN=C(C(=C3)C#N)Cl

InChI

InChI=1S/C14H14ClN3/c15-14-11(5-16)4-13(8-18-14)9-1-2-10-6-17-7-12(10)3-9/h3-4,8,10,12,17H,1-2,6-7H2