4-nitro-5-[4-(4-nitrophenyl)piperazin-1-yl]benzene-1,2-dicarbonitrile

Systemtic Name: 4-nitro-5-[4-(4-nitrophenyl)piperazin-1-yl]benzene-1,2-dicarbonitrile Openeye Name: 4-nitro-5-[4-(4-nitrophenyl)piperazin-1-yl]phthalonitrile CAS Name: 4-nitro-5-[4-(4-nitrophenyl)-1-piperazinyl]benzene-1,2-dicarbonitrile IUPAC Name: 4-nitro-5-[4-(4-nitrophenyl)piperazin-1-yl]benzene-1,2-dicarbonitrile Traditional Name: 4-nitro-5-[4-(4-nitrophenyl)piperazino]phthalonitrile Formula: C18H14N6O4 MolecularWeight: 378.34156

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=C(C=C(C(=C3)C#N)C#N)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=C(C=C(C(=C3)C#N)C#N)[N+](=O)[O-]

InChI

InChI=1S/C18H14N6O4/c19-11-13-9-17(18(24(27)28)10-14(13)12-20)22-7-5-21(6-8-22)15-1-3-16(4-2-15)23(25)26/h1-4,9-10H,5-8H2