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

Systemtic Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)propanedinitrile Openeye Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)propanedinitrile CAS Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)propanedinitrile IUPAC Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)propanedinitrile Traditional Name: 2-(3,3-dimethyl-4H-isoquinolin-1-yl)malononitrile Formula: C14H13N3 MolecularWeight: 223.27312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3/c1-14(2)7-10-5-3-4-6-12(10)13(17-14)11(8-15)9-16/h3-6,11H,7H2,1-2H3