2-bromanyl-3-(cyanomethyl)-4,6-diethyl-benzenecarbonitrile

Systemtic Name: 2-bromanyl-3-(cyanomethyl)-4,6-diethyl-benzenecarbonitrile Openeye Name: 2-bromo-3-(cyanomethyl)-4,6-diethyl-benzonitrile CAS Name: 2-bromo-3-(cyanomethyl)-4,6-diethylbenzonitrile IUPAC Name: 2-bromo-3-(cyanomethyl)-4,6-diethylbenzonitrile Traditional Name: 2-bromo-3-(cyanomethyl)-4,6-diethyl-benzonitrile Formula: C13H13BrN2 MolecularWeight: 277.15972

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C(=C1C#N)Br)CC#N)CC

Isomeric SMILES

CCC1=CC(=C(C(=C1C#N)Br)CC#N)CC

InChI

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