2-(4-ethylpiperazin-1-yl)-5-nitro-benzenecarbonitrile

Systemtic Name: 2-(4-ethylpiperazin-1-yl)-5-nitro-benzenecarbonitrile Openeye Name: 2-(4-ethylpiperazin-1-yl)-5-nitro-benzonitrile CAS Name: 2-(4-ethyl-1-piperazinyl)-5-nitrobenzonitrile IUPAC Name: 2-(4-ethylpiperazin-1-yl)-5-nitrobenzonitrile Traditional Name: 2-(4-ethylpiperazino)-5-nitro-benzonitrile Formula: C13H16N4O2 MolecularWeight: 260.29174

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C13H16N4O2/c1-2-15-5-7-16(8-6-15)13-4-3-12(17(18)19)9-11(13)10-14/h3-4,9H,2,5-8H2,1H3