5-tert-butyl-3-(cyanomethyl)-2-methyl-benzenecarbonitrile

Systemtic Name: 5-tert-butyl-3-(cyanomethyl)-2-methyl-benzenecarbonitrile Openeye Name: 5-tert-butyl-3-(cyanomethyl)-2-methyl-benzonitrile CAS Name: 5-tert-butyl-3-(cyanomethyl)-2-methylbenzonitrile IUPAC Name: 5-tert-butyl-3-(cyanomethyl)-2-methylbenzonitrile Traditional Name: 5-tert-butyl-3-(cyanomethyl)-2-methyl-benzonitrile Formula: C14H16N2 MolecularWeight: 212.29024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C#N)C(C)(C)C)CC#N

Isomeric SMILES

CC1=C(C=C(C=C1C#N)C(C)(C)C)CC#N

InChI

InChI=1S/C14H16N2/c1-10-11(5-6-15)7-13(14(2,3)4)8-12(10)9-16/h7-8H,5H2,1-4H3