5-bromanyl-4-(cyanomethyl)-2-(2-methylbutan-2-yl)benzenecarbonitrile

Systemtic Name: 5-bromanyl-4-(cyanomethyl)-2-(2-methylbutan-2-yl)benzenecarbonitrile Openeye Name: 5-bromo-4-(cyanomethyl)-2-(1,1-dimethylpropyl)benzonitrile CAS Name: 5-bromo-4-(cyanomethyl)-2-(2-methylbutan-2-yl)benzonitrile IUPAC Name: 5-bromo-4-(cyanomethyl)-2-(2-methylbutan-2-yl)benzonitrile Traditional Name: 2-tert-amyl-5-bromo-4-(cyanomethyl)benzonitrile Formula: C14H15BrN2 MolecularWeight: 291.1863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15BrN2/c1-4-14(2,3)12-7-10(5-6-16)13(15)8-11(12)9-17/h7-8H,4-5H2,1-3H3