2-butan-2-yl-4-tert-butyl-5-(cyanomethyl)benzenecarbonitrile

Systemtic Name: 2-butan-2-yl-4-tert-butyl-5-(cyanomethyl)benzenecarbonitrile Openeye Name: 4-tert-butyl-5-(cyanomethyl)-2-sec-butyl-benzonitrile CAS Name: 2-butan-2-yl-4-tert-butyl-5-(cyanomethyl)benzonitrile IUPAC Name: 2-butan-2-yl-4-tert-butyl-5-(cyanomethyl)benzonitrile Traditional Name: 4-tert-butyl-5-(cyanomethyl)-2-sec-butyl-benzonitrile Formula: C17H22N2 MolecularWeight: 254.36998

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=C(C=C1C#N)CC#N)C(C)(C)C

Isomeric SMILES

CCC(C)C1=CC(=C(C=C1C#N)CC#N)C(C)(C)C

InChI

InChI=1S/C17H22N2/c1-6-12(2)15-10-16(17(3,4)5)13(7-8-18)9-14(15)11-19/h9-10,12H,6-7H2,1-5H3