2-[4-(2-chloranyl-4-nitro-phenyl)piperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-(2-chloranyl-4-nitro-phenyl)piperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-(2-chloro-4-nitro-phenyl)piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-(2-chloro-4-nitrophenyl)-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-(2-chloro-4-nitro-phenyl)piperazino]isonicotinonitrile Formula: C16H14ClN5O2 MolecularWeight: 343.76766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14ClN5O2/c17-14-10-13(22(23)24)1-2-15(14)20-5-7-21(8-6-20)16-9-12(11-18)3-4-19-16/h1-4,9-10H,5-8H2