2-tert-butyl-5-(cyanomethyl)-4-(2-methylpropyl)benzenecarbonitrile

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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