3-nitro-2,6-bis(pyridin-3-ylmethylamino)benzenecarbonitrile

Systemtic Name: 3-nitro-2,6-bis(pyridin-3-ylmethylamino)benzenecarbonitrile Openeye Name: 3-nitro-2,6-bis(3-pyridylmethylamino)benzonitrile CAS Name: 3-nitro-2,6-bis(3-pyridinylmethylamino)benzonitrile IUPAC Name: 3-nitro-2,6-bis(pyridin-3-ylmethylamino)benzonitrile Traditional Name: 3-nitro-2,6-bis(3-pyridylmethylamino)benzonitrile Formula: C19H16N6O2 MolecularWeight: 360.36934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC2=C(C(=C(C=C2)[N+](=O)[O-])NCC3=CN=CC=C3)C#N

Isomeric SMILES

C1=CC(=CN=C1)CNC2=C(C(=C(C=C2)[N+](=O)[O-])NCC3=CN=CC=C3)C#N

InChI

InChI=1S/C19H16N6O2/c20-9-16-17(23-12-14-3-1-7-21-10-14)5-6-18(25(26)27)19(16)24-13-15-4-2-8-22-11-15/h1-8,10-11,23-24H,12-13H2