1-[(5-fluoranyl-2-nitro-phenoxy)methyl]-N-(4-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: 1-[(5-fluoranyl-2-nitro-phenoxy)methyl]-N-(4-nitrophenyl)pyrazole-3-carboxamide Openeye Name: 1-[(5-fluoro-2-nitro-phenoxy)methyl]-N-(4-nitrophenyl)pyrazole-3-carboxamide CAS Name: 1-[(5-fluoro-2-nitrophenoxy)methyl]-N-(4-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(5-fluoro-2-nitrophenoxy)methyl]-N-(4-nitrophenyl)pyrazole-3-carboxamide Traditional Name: 1-[(5-fluoro-2-nitro-phenoxy)methyl]-N-(4-nitrophenyl)pyrazole-3-carboxamide Formula: C17H12FN5O6 MolecularWeight: 401.305483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C2=NN(C=C2)COC3=C(C=CC(=C3)F)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C2=NN(C=C2)COC3=C(C=CC(=C3)F)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H12FN5O6/c18-11-1-6-15(23(27)28)16(9-11)29-10-21-8-7-14(20-21)17(24)19-12-2-4-13(5-3-12)22(25)26/h1-9H,10H2,(H,19,24)