2-(2,3-dimethylbutan-2-yl)-4-methyl-benzenecarbonitrile

Systemtic Name: 2-(2,3-dimethylbutan-2-yl)-4-methyl-benzenecarbonitrile Openeye Name: 4-methyl-2-(1,1,2-trimethylpropyl)benzonitrile CAS Name: 2-(2,3-dimethylbutan-2-yl)-4-methylbenzonitrile IUPAC Name: 2-(2,3-dimethylbutan-2-yl)-4-methylbenzonitrile Traditional Name: 4-methyl-2-thexyl-benzonitrile Formula: C14H19N MolecularWeight: 201.30736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N/c1-10(2)14(4,5)13-8-11(3)6-7-12(13)9-15/h6-8,10H,1-5H3