4-chloranyl-3-(cyanomethyl)-2-(2-methylbutan-2-yl)benzenecarbonitrile

Systemtic Name: 4-chloranyl-3-(cyanomethyl)-2-(2-methylbutan-2-yl)benzenecarbonitrile Openeye Name: 4-chloro-3-(cyanomethyl)-2-(1,1-dimethylpropyl)benzonitrile CAS Name: 4-chloro-3-(cyanomethyl)-2-(2-methylbutan-2-yl)benzonitrile IUPAC Name: 4-chloro-3-(cyanomethyl)-2-(2-methylbutan-2-yl)benzonitrile Traditional Name: 2-tert-amyl-4-chloro-3-(cyanomethyl)benzonitrile Formula: C14H15ClN2 MolecularWeight: 246.7353

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=C(C=CC(=C1CC#N)Cl)C#N

Isomeric SMILES

CCC(C)(C)C1=C(C=CC(=C1CC#N)Cl)C#N

InChI

InChI=1S/C14H15ClN2/c1-4-14(2,3)13-10(9-17)5-6-12(15)11(13)7-8-16/h5-6H,4,7H2,1-3H3