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

Systemtic Name: 1-[(5-fluoranyl-2-nitro-phenoxy)methyl]-N-(2-methylpropyl)pyrazole-3-carboxamide Openeye Name: 1-[(5-fluoro-2-nitro-phenoxy)methyl]-N-isobutyl-pyrazole-3-carboxamide CAS Name: 1-[(5-fluoro-2-nitrophenoxy)methyl]-N-(2-methylpropyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(5-fluoro-2-nitrophenoxy)methyl]-N-(2-methylpropyl)pyrazole-3-carboxamide Traditional Name: 1-[(5-fluoro-2-nitro-phenoxy)methyl]-N-isobutyl-pyrazole-3-carboxamide Formula: C15H17FN4O4 MolecularWeight: 336.318283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=NN(C=C1)COC2=C(C=CC(=C2)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)CNC(=O)C1=NN(C=C1)COC2=C(C=CC(=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C15H17FN4O4/c1-10(2)8-17-15(21)12-5-6-19(18-12)9-24-14-7-11(16)3-4-13(14)20(22)23/h3-7,10H,8-9H2,1-2H3,(H,17,21)