2-(3,3-diethyl-4H-isoquinolin-1-yl)-2-phenyl-ethanenitrile

Systemtic Name: 2-(3,3-diethyl-4H-isoquinolin-1-yl)-2-phenyl-ethanenitrile Openeye Name: 2-(3,3-diethyl-4H-isoquinolin-1-yl)-2-phenyl-acetonitrile CAS Name: 2-(3,3-diethyl-4H-isoquinolin-1-yl)-2-phenylacetonitrile IUPAC Name: 2-(3,3-diethyl-4H-isoquinolin-1-yl)-2-phenylacetonitrile Traditional Name: 2-(3,3-diethyl-4H-isoquinolin-1-yl)-2-phenyl-acetonitrile Formula: C21H22N2 MolecularWeight: 302.41278

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC2=CC=CC=C2C(=N1)C(C#N)C3=CC=CC=C3)CC

Isomeric SMILES

CCC1(CC2=CC=CC=C2C(=N1)C(C#N)C3=CC=CC=C3)CC

InChI

InChI=1S/C21H22N2/c1-3-21(4-2)14-17-12-8-9-13-18(17)20(23-21)19(15-22)16-10-6-5-7-11-16/h5-13,19H,3-4,14H2,1-2H3