2-nitro-N'-[5-nitro-6-(pyridin-3-ylamino)pyrimidin-4-yl]benzohydrazide

Systemtic Name: 2-nitro-N'-[5-nitro-6-(pyridin-3-ylamino)pyrimidin-4-yl]benzohydrazide Openeye Name: 2-nitro-N'-[5-nitro-6-(3-pyridylamino)pyrimidin-4-yl]benzohydrazide CAS Name: 2-nitro-N'-[5-nitro-6-(3-pyridinylamino)-4-pyrimidinyl]benzohydrazide IUPAC Name: 2-nitro-N'-[5-nitro-6-(pyridin-3-ylamino)pyrimidin-4-yl]benzohydrazide Traditional Name: 2-nitro-N'-[5-nitro-6-(3-pyridylamino)pyrimidin-4-yl]benzohydrazide Formula: C16H12N8O5 MolecularWeight: 396.31708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NC3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NC3=CN=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N8O5/c25-16(11-5-1-2-6-12(11)23(26)27)22-21-15-13(24(28)29)14(18-9-19-15)20-10-4-3-7-17-8-10/h1-9H,(H,22,25)(H2,18,19,20,21)