2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)benzenecarbonitrile

Systemtic Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)benzenecarbonitrile Openeye Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)benzonitrile CAS Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)benzonitrile IUPAC Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)benzonitrile Traditional Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)benzonitrile Formula: C16H20N2 MolecularWeight: 240.3434

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2CN(CCC2C1)C3=CC=CC=C3C#N

Isomeric SMILES

C1CCC2CN(CCC2C1)C3=CC=CC=C3C#N

InChI

InChI=1S/C16H20N2/c17-11-14-6-3-4-8-16(14)18-10-9-13-5-1-2-7-15(13)12-18/h3-4,6,8,13,15H,1-2,5,7,9-10,12H2