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

Systemtic Name: 4-chloranyl-3-nitro-N'-[5-nitro-6-(pyridin-4-ylamino)pyrimidin-4-yl]benzohydrazide Openeye Name: 4-chloro-3-nitro-N'-[5-nitro-6-(4-pyridylamino)pyrimidin-4-yl]benzohydrazide CAS Name: 4-chloro-3-nitro-N'-[5-nitro-6-(pyridin-4-ylamino)-4-pyrimidinyl]benzohydrazide IUPAC Name: 4-chloro-3-nitro-N'-[5-nitro-6-(pyridin-4-ylamino)pyrimidin-4-yl]benzohydrazide Traditional Name: 4-chloro-3-nitro-N'-[5-nitro-6-(4-pyridylamino)pyrimidin-4-yl]benzohydrazide Formula: C16H11ClN8O5 MolecularWeight: 430.76214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=NC=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=NC=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H11ClN8O5/c17-11-2-1-9(7-12(11)24(27)28)16(26)23-22-15-13(25(29)30)14(19-8-20-15)21-10-3-5-18-6-4-10/h1-8H,(H,23,26)(H2,18,19,20,21,22)