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

Systemtic Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-2-phenyl-ethanenitrile Openeye Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-2-phenyl-acetonitrile CAS Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-2-phenylacetonitrile IUPAC Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-2-phenylacetonitrile Traditional Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)-2-phenyl-acetonitrile Formula: C19H18N2 MolecularWeight: 274.35962

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=N1)C(C#N)C3=CC=CC=C3)C

Isomeric SMILES

CC1(CC2=CC=CC=C2C(=N1)C(C#N)C3=CC=CC=C3)C

InChI

InChI=1S/C19H18N2/c1-19(2)12-15-10-6-7-11-16(15)18(21-19)17(13-20)14-8-4-3-5-9-14/h3-11,17H,12H2,1-2H3