N'-[6-(5-bromanylquinolin-8-yl)oxy-5-nitro-pyrimidin-4-yl]-4-fluoranyl-benzohydrazide

Systemtic Name: N'-[6-(5-bromanylquinolin-8-yl)oxy-5-nitro-pyrimidin-4-yl]-4-fluoranyl-benzohydrazide Openeye Name: N'-[6-[(5-bromo-8-quinolyl)oxy]-5-nitro-pyrimidin-4-yl]-4-fluoro-benzohydrazide CAS Name: N'-[6-[(5-bromo-8-quinolinyl)oxy]-5-nitro-4-pyrimidinyl]-4-fluorobenzohydrazide IUPAC Name: N'-[6-(5-bromoquinolin-8-yl)oxy-5-nitropyrimidin-4-yl]-4-fluorobenzohydrazide Traditional Name: N'-[6-[(5-bromo-8-quinolyl)oxy]-5-nitro-pyrimidin-4-yl]-4-fluoro-benzohydrazide Formula: C20H12BrFN6O4 MolecularWeight: 499.249483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2N=C1)OC3=NC=NC(=C3[N+](=O)[O-])NNC(=O)C4=CC=C(C=C4)F)Br

Isomeric SMILES

C1=CC2=C(C=CC(=C2N=C1)OC3=NC=NC(=C3[N+](=O)[O-])NNC(=O)C4=CC=C(C=C4)F)Br

InChI

InChI=1S/C20H12BrFN6O4/c21-14-7-8-15(16-13(14)2-1-9-23-16)32-20-17(28(30)31)18(24-10-25-20)26-27-19(29)11-3-5-12(22)6-4-11/h1-10H,(H,27,29)(H,24,25,26)