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

Systemtic Name: 2-tert-butyl-3-chloranyl-4-(cyanomethyl)benzenecarbonitrile Openeye Name: 2-tert-butyl-3-chloro-4-(cyanomethyl)benzonitrile CAS Name: 2-tert-butyl-3-chloro-4-(cyanomethyl)benzonitrile IUPAC Name: 2-tert-butyl-3-chloro-4-(cyanomethyl)benzonitrile Traditional Name: 2-tert-butyl-3-chloro-4-(cyanomethyl)benzonitrile Formula: C13H13ClN2 MolecularWeight: 232.70872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1Cl)CC#N)C#N

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1Cl)CC#N)C#N

InChI

InChI=1S/C13H13ClN2/c1-13(2,3)11-10(8-16)5-4-9(6-7-15)12(11)14/h4-5H,6H2,1-3H3