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

Systemtic Name: N-[(1,3-dimethylpyrazol-4-yl)methyl]-1-[(5-fluoranyl-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-[(1,3-dimethylpyrazol-4-yl)methyl]-1-[(5-fluoro-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-[(1,3-dimethyl-4-pyrazolyl)methyl]-1-[(5-fluoro-2-nitrophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[(1,3-dimethylpyrazol-4-yl)methyl]-1-[(5-fluoro-2-nitrophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-[(1,3-dimethylpyrazol-4-yl)methyl]-1-[(5-fluoro-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide Formula: C17H17FN6O4 MolecularWeight: 388.353083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CNC(=O)C2=NN(C=C2)COC3=C(C=CC(=C3)F)[N+](=O)[O-])C

Isomeric SMILES

CC1=NN(C=C1CNC(=O)C2=NN(C=C2)COC3=C(C=CC(=C3)F)[N+](=O)[O-])C

InChI

InChI=1S/C17H17FN6O4/c1-11-12(9-22(2)20-11)8-19-17(25)14-5-6-23(21-14)10-28-16-7-13(18)3-4-15(16)24(26)27/h3-7,9H,8,10H2,1-2H3,(H,19,25)