3-(cyanomethyl)-5-(2-methylbutan-2-yl)-2-(2-methylpropyl)benzenecarbonitrile

Systemtic Name: 3-(cyanomethyl)-5-(2-methylbutan-2-yl)-2-(2-methylpropyl)benzenecarbonitrile Openeye Name: 3-(cyanomethyl)-5-(1,1-dimethylpropyl)-2-isobutyl-benzonitrile CAS Name: 3-(cyanomethyl)-5-(2-methylbutan-2-yl)-2-(2-methylpropyl)benzonitrile IUPAC Name: 3-(cyanomethyl)-5-(2-methylbutan-2-yl)-2-(2-methylpropyl)benzonitrile Traditional Name: 5-tert-amyl-3-(cyanomethyl)-2-isobutyl-benzonitrile Formula: C18H24N2 MolecularWeight: 268.39656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N2/c1-6-18(4,5)16-10-14(7-8-19)17(9-13(2)3)15(11-16)12-20/h10-11,13H,6-7,9H2,1-5H3