1-[4-(5-fluoranyl-2-oxidanyl-phenyl)carbonylpyrazol-1-yl]-2-(2-nitrophenoxy)ethanone

Systemtic Name: 1-[4-(5-fluoranyl-2-oxidanyl-phenyl)carbonylpyrazol-1-yl]-2-(2-nitrophenoxy)ethanone Openeye Name: 1-[4-(5-fluoro-2-hydroxy-benzoyl)pyrazol-1-yl]-2-(2-nitrophenoxy)ethanone CAS Name: 1-[4-[(5-fluoro-2-hydroxyphenyl)-oxomethyl]-1-pyrazolyl]-2-(2-nitrophenoxy)ethanone IUPAC Name: 1-[4-(5-fluoro-2-hydroxybenzoyl)pyrazol-1-yl]-2-(2-nitrophenoxy)ethanone Traditional Name: 1-[4-(5-fluoro-2-hydroxy-benzoyl)pyrazol-1-yl]-2-(2-nitrophenoxy)ethanone Formula: C18H12FN3O6 MolecularWeight: 385.302783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[N+](=O)[O-])OCC(=O)N2C=C(C=N2)C(=O)C3=C(C=CC(=C3)F)O

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])OCC(=O)N2C=C(C=N2)C(=O)C3=C(C=CC(=C3)F)O

InChI

InChI=1S/C18H12FN3O6/c19-12-5-6-15(23)13(7-12)18(25)11-8-20-21(9-11)17(24)10-28-16-4-2-1-3-14(16)22(26)27/h1-9,23H,10H2