N-(2-chloranyl-5-nitro-phenyl)-1-[(5-fluoranyl-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-1-[(5-fluoranyl-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-1-[(5-fluoro-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(2-chloro-5-nitrophenyl)-1-[(5-fluoro-2-nitrophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-1-[(5-fluoro-2-nitrophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-1-[(5-fluoro-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide Formula: C17H11ClFN5O6 MolecularWeight: 435.750543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])NC(=O)C2=NN(C=C2)COC3=C(C=CC(=C3)F)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])NC(=O)C2=NN(C=C2)COC3=C(C=CC(=C3)F)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H11ClFN5O6/c18-12-3-2-11(23(26)27)8-14(12)20-17(25)13-5-6-22(21-13)9-30-16-7-10(19)1-4-15(16)24(28)29/h1-8H,9H2,(H,20,25)