3-chloranyl-N'-[5-nitro-6-[2-(phenylcarbonyl)hydrazinyl]pyrimidin-4-yl]benzohydrazide

Systemtic Name: 3-chloranyl-N'-[5-nitro-6-[2-(phenylcarbonyl)hydrazinyl]pyrimidin-4-yl]benzohydrazide Openeye Name: N'-[6-(2-benzoylhydrazino)-5-nitro-pyrimidin-4-yl]-3-chloro-benzohydrazide CAS Name: N'-[6-(benzoylhydrazo)-5-nitro-4-pyrimidinyl]-3-chlorobenzohydrazide IUPAC Name: N'-[6-(2-benzoylhydrazinyl)-5-nitropyrimidin-4-yl]-3-chlorobenzohydrazide Traditional Name: N'-[6-(N'-benzoylhydrazino)-5-nitro-pyrimidin-4-yl]-3-chloro-benzohydrazide Formula: C18H14ClN7O4 MolecularWeight: 427.80126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NNC2=C(C(=NC=N2)NNC(=O)C3=CC(=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NNC2=C(C(=NC=N2)NNC(=O)C3=CC(=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H14ClN7O4/c19-13-8-4-7-12(9-13)18(28)25-23-16-14(26(29)30)15(20-10-21-16)22-24-17(27)11-5-2-1-3-6-11/h1-10H,(H,24,27)(H,25,28)(H2,20,21,22,23)