3-(cyanomethyl)-4-ethyl-5-nitro-benzenecarbonitrile

Systemtic Name: 3-(cyanomethyl)-4-ethyl-5-nitro-benzenecarbonitrile Openeye Name: 3-(cyanomethyl)-4-ethyl-5-nitro-benzonitrile CAS Name: 3-(cyanomethyl)-4-ethyl-5-nitrobenzonitrile IUPAC Name: 3-(cyanomethyl)-4-ethyl-5-nitrobenzonitrile Traditional Name: 3-(cyanomethyl)-4-ethyl-5-nitro-benzonitrile Formula: C11H9N3O2 MolecularWeight: 215.20806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1[N+](=O)[O-])C#N)CC#N

Isomeric SMILES

CCC1=C(C=C(C=C1[N+](=O)[O-])C#N)CC#N

InChI

InChI=1S/C11H9N3O2/c1-2-10-9(3-4-12)5-8(7-13)6-11(10)14(15)16/h5-6H,2-3H2,1H3