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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2/c17-11-13-5-7-16(8-6-13)18-10-9-14-3-1-2-4-15(14)12-18/h5-8,14-15H,1-4,9-10,12H2