2-bromanyl-6-butan-2-yl-4-(cyanomethyl)benzenecarbonitrile

Systemtic Name: 2-bromanyl-6-butan-2-yl-4-(cyanomethyl)benzenecarbonitrile Openeye Name: 2-bromo-4-(cyanomethyl)-6-sec-butyl-benzonitrile CAS Name: 2-bromo-6-butan-2-yl-4-(cyanomethyl)benzonitrile IUPAC Name: 2-bromo-6-butan-2-yl-4-(cyanomethyl)benzonitrile Traditional Name: 2-bromo-4-(cyanomethyl)-6-sec-butyl-benzonitrile Formula: C13H13BrN2 MolecularWeight: 277.15972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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