3-bromanyl-5-(cyanomethyl)-2,6-diethyl-benzenecarbonitrile

Systemtic Name: 3-bromanyl-5-(cyanomethyl)-2,6-diethyl-benzenecarbonitrile Openeye Name: 3-bromo-5-(cyanomethyl)-2,6-diethyl-benzonitrile CAS Name: 3-bromo-5-(cyanomethyl)-2,6-diethylbenzonitrile IUPAC Name: 3-bromo-5-(cyanomethyl)-2,6-diethylbenzonitrile Traditional Name: 3-bromo-5-(cyanomethyl)-2,6-diethyl-benzonitrile Formula: C13H13BrN2 MolecularWeight: 277.15972

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1CC#N)Br)CC)C#N

Isomeric SMILES

CCC1=C(C(=C(C=C1CC#N)Br)CC)C#N

InChI

InChI=1S/C13H13BrN2/c1-3-10-9(5-6-15)7-13(14)11(4-2)12(10)8-16/h7H,3-5H2,1-2H3