N'-[6-(4-chloranyl-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]-4-fluoranyl-benzohydrazide

Systemtic Name: N'-[6-(4-chloranyl-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]-4-fluoranyl-benzohydrazide Openeye Name: N'-[6-(4-chloro-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]-4-fluoro-benzohydrazide CAS Name: N'-[6-(4-chloro-3-methylphenoxy)-5-nitro-4-pyrimidinyl]-4-fluorobenzohydrazide IUPAC Name: N'-[6-(4-chloro-3-methylphenoxy)-5-nitropyrimidin-4-yl]-4-fluorobenzohydrazide Traditional Name: N'-[6-(4-chloro-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]-4-fluoro-benzohydrazide Formula: C18H13ClFN5O4 MolecularWeight: 417.778323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NNC(=O)C3=CC=C(C=C3)F)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NNC(=O)C3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C18H13ClFN5O4/c1-10-8-13(6-7-14(10)19)29-18-15(25(27)28)16(21-9-22-18)23-24-17(26)11-2-4-12(20)5-3-11/h2-9H,1H3,(H,24,26)(H,21,22,23)