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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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