4-(4-methylpiperazin-1-yl)-3-nitro-benzenecarbonitrile

Systemtic Name: 4-(4-methylpiperazin-1-yl)-3-nitro-benzenecarbonitrile Openeye Name: 4-(4-methylpiperazin-1-yl)-3-nitro-benzonitrile CAS Name: 4-(4-methyl-1-piperazinyl)-3-nitrobenzonitrile IUPAC Name: 4-(4-methylpiperazin-1-yl)-3-nitrobenzonitrile Traditional Name: 4-(4-methylpiperazino)-3-nitro-benzonitrile Formula: C12H14N4O2 MolecularWeight: 246.26516

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O2/c1-14-4-6-15(7-5-14)11-3-2-10(9-13)8-12(11)16(17)18/h2-3,8H,4-7H2,1H3