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

Systemtic Name: N'-[6-[(3-chloranyl-4-fluoranyl-phenyl)amino]-5-nitro-pyrimidin-4-yl]-4-nitro-benzohydrazide Openeye Name: N'-[6-(3-chloro-4-fluoro-anilino)-5-nitro-pyrimidin-4-yl]-4-nitro-benzohydrazide CAS Name: N'-[6-(3-chloro-4-fluoroanilino)-5-nitro-4-pyrimidinyl]-4-nitrobenzohydrazide IUPAC Name: N'-[6-(3-chloro-4-fluoroanilino)-5-nitropyrimidin-4-yl]-4-nitrobenzohydrazide Traditional Name: N'-[6-(3-chloro-4-fluoro-anilino)-5-nitro-pyrimidin-4-yl]-4-nitro-benzohydrazide Formula: C17H11ClFN7O5 MolecularWeight: 447.764543

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H11ClFN7O5/c18-12-7-10(3-6-13(12)19)22-15-14(26(30)31)16(21-8-20-15)23-24-17(27)9-1-4-11(5-2-9)25(28)29/h1-8H,(H,24,27)(H2,20,21,22,23)