2-[4-(2,4-dinitrophenyl)piperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-(2,4-dinitrophenyl)piperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-(2,4-dinitrophenyl)piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-(2,4-dinitrophenyl)-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-(2,4-dinitrophenyl)piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-(2,4-dinitrophenyl)piperazino]isonicotinonitrile Formula: C16H14N6O4 MolecularWeight: 354.32016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N6O4/c17-11-12-3-4-18-16(9-12)20-7-5-19(6-8-20)14-2-1-13(21(23)24)10-15(14)22(25)26/h1-4,9-10H,5-8H2