5-nitro-2-[(2-pyrazol-1-ylpyridin-3-yl)methylamino]benzenecarbonitrile

Systemtic Name: 5-nitro-2-[(2-pyrazol-1-ylpyridin-3-yl)methylamino]benzenecarbonitrile Openeye Name: 5-nitro-2-[(2-pyrazol-1-yl-3-pyridyl)methylamino]benzonitrile CAS Name: 5-nitro-2-[[2-(1-pyrazolyl)-3-pyridinyl]methylamino]benzonitrile IUPAC Name: 5-nitro-2-[(2-pyrazol-1-ylpyridin-3-yl)methylamino]benzonitrile Traditional Name: 5-nitro-2-[(2-pyrazol-1-yl-3-pyridyl)methylamino]benzonitrile Formula: C16H12N6O2 MolecularWeight: 320.30548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)N2C=CC=N2)CNC3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC(=C(N=C1)N2C=CC=N2)CNC3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C16H12N6O2/c17-10-13-9-14(22(23)24)4-5-15(13)19-11-12-3-1-6-18-16(12)21-8-2-7-20-21/h1-9,19H,11H2