5-nitro-6-[(2-nitrophenyl)methylamino]pyridine-3-carbonitrile

Systemtic Name: 5-nitro-6-[(2-nitrophenyl)methylamino]pyridine-3-carbonitrile Openeye Name: 5-nitro-6-[(2-nitrophenyl)methylamino]pyridine-3-carbonitrile CAS Name: 5-nitro-6-[(2-nitrophenyl)methylamino]-3-pyridinecarbonitrile IUPAC Name: 5-nitro-6-[(2-nitrophenyl)methylamino]pyridine-3-carbonitrile Traditional Name: 5-nitro-6-[(2-nitrobenzyl)amino]nicotinonitrile Formula: C13H9N5O4 MolecularWeight: 299.24166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC2=C(C=C(C=N2)C#N)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)CNC2=C(C=C(C=N2)C#N)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H9N5O4/c14-6-9-5-12(18(21)22)13(15-7-9)16-8-10-3-1-2-4-11(10)17(19)20/h1-5,7H,8H2,(H,15,16)