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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1C#N)Br)CC#N

Isomeric SMILES

CCCCC1=CC(=C(C=C1C#N)Br)CC#N

InChI

InChI=1S/C13H13BrN2/c1-2-3-4-10-7-11(5-6-15)13(14)8-12(10)9-16/h7-8H,2-5H2,1H3