2-(3,5-dimethylpiperazin-1-yl)-5-nitro-benzenecarbonitrile

Systemtic Name: 2-(3,5-dimethylpiperazin-1-yl)-5-nitro-benzenecarbonitrile Openeye Name: 2-(3,5-dimethylpiperazin-1-yl)-5-nitro-benzonitrile CAS Name: 2-(3,5-dimethyl-1-piperazinyl)-5-nitrobenzonitrile IUPAC Name: 2-(3,5-dimethylpiperazin-1-yl)-5-nitrobenzonitrile Traditional Name: 2-(3,5-dimethylpiperazino)-5-nitro-benzonitrile Formula: C13H16N4O2 MolecularWeight: 260.29174

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1)C)C2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CC1CN(CC(N1)C)C2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

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