2-bromanyl-4-tert-butyl-5-(cyanomethyl)benzenecarbonitrile

Systemtic Name: 2-bromanyl-4-tert-butyl-5-(cyanomethyl)benzenecarbonitrile Openeye Name: 2-bromo-4-tert-butyl-5-(cyanomethyl)benzonitrile CAS Name: 2-bromo-4-tert-butyl-5-(cyanomethyl)benzonitrile IUPAC Name: 2-bromo-4-tert-butyl-5-(cyanomethyl)benzonitrile Traditional Name: 2-bromo-4-tert-butyl-5-(cyanomethyl)benzonitrile Formula: C13H13BrN2 MolecularWeight: 277.15972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13BrN2/c1-13(2,3)11-7-12(14)10(8-16)6-9(11)4-5-15/h6-7H,4H2,1-3H3