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

Systemtic Name: 3-chloranyl-N'-[6-[2-(4-fluorophenyl)carbonylhydrazinyl]-5-nitro-pyrimidin-4-yl]benzohydrazide Openeye Name: 3-chloro-N'-[6-[2-(4-fluorobenzoyl)hydrazino]-5-nitro-pyrimidin-4-yl]benzohydrazide CAS Name: 3-chloro-N'-[6-[[(4-fluorophenyl)-oxomethyl]hydrazo]-5-nitro-4-pyrimidinyl]benzohydrazide IUPAC Name: 3-chloro-N'-[6-[2-(4-fluorobenzoyl)hydrazinyl]-5-nitropyrimidin-4-yl]benzohydrazide Traditional Name: 3-chloro-N'-[6-[N'-(4-fluorobenzoyl)hydrazino]-5-nitro-pyrimidin-4-yl]benzohydrazide Formula: C18H13ClFN7O4 MolecularWeight: 445.791723

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13ClFN7O4/c19-12-3-1-2-11(8-12)18(29)26-24-16-14(27(30)31)15(21-9-22-16)23-25-17(28)10-4-6-13(20)7-5-10/h1-9H,(H,25,28)(H,26,29)(H2,21,22,23,24)