4-tert-butyl-3-(cyanomethyl)benzenecarbonitrile

Systemtic Name: 4-tert-butyl-3-(cyanomethyl)benzenecarbonitrile Openeye Name: 4-tert-butyl-3-(cyanomethyl)benzonitrile CAS Name: 4-tert-butyl-3-(cyanomethyl)benzonitrile IUPAC Name: 4-tert-butyl-3-(cyanomethyl)benzonitrile Traditional Name: 4-tert-butyl-3-(cyanomethyl)benzonitrile Formula: C13H14N2 MolecularWeight: 198.26366

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2/c1-13(2,3)12-5-4-10(9-15)8-11(12)6-7-14/h4-5,8H,6H2,1-3H3