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

Systemtic Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-[(5-fluoranyl-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-[(5-fluoro-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-[3-(3,5-dimethyl-1-pyrazolyl)propyl]-1-[(5-fluoro-2-nitrophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-[(5-fluoro-2-nitrophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-1-[(5-fluoro-2-nitro-phenoxy)methyl]pyrazole-3-carboxamide Formula: C19H21FN6O4 MolecularWeight: 416.406243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCCNC(=O)C2=NN(C=C2)COC3=C(C=CC(=C3)F)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1CCCNC(=O)C2=NN(C=C2)COC3=C(C=CC(=C3)F)[N+](=O)[O-])C

InChI

InChI=1S/C19H21FN6O4/c1-13-10-14(2)25(22-13)8-3-7-21-19(27)16-6-9-24(23-16)12-30-18-11-15(20)4-5-17(18)26(28)29/h4-6,9-11H,3,7-8,12H2,1-2H3,(H,21,27)