2,2-bis(2,6-dimethylphenyl)ethanenitrile

Systemtic Name: 2,2-bis(2,6-dimethylphenyl)ethanenitrile Openeye Name: 2,2-bis(2,6-dimethylphenyl)acetonitrile CAS Name: 2,2-bis(2,6-dimethylphenyl)acetonitrile IUPAC Name: 2,2-bis(2,6-dimethylphenyl)acetonitrile Traditional Name: 2,2-bis(2,6-dimethylphenyl)acetonitrile Formula: C18H19N MolecularWeight: 249.35016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C(C#N)C2=C(C=CC=C2C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)C(C#N)C2=C(C=CC=C2C)C

InChI

InChI=1S/C18H19N/c1-12-7-5-8-13(2)17(12)16(11-19)18-14(3)9-6-10-15(18)4/h5-10,16H,1-4H3