1-methyl-N-(3-nitro-5-pyridin-3-yloxy-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: 1-methyl-N-(3-nitro-5-pyridin-3-yloxy-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: 1-methyl-N-[3-nitro-5-(3-pyridyloxy)phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: 1-methyl-N-[3-nitro-5-(3-pyridinyloxy)phenyl]-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: 1-methyl-N-(3-nitro-5-pyridin-3-yloxyphenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: 1-methyl-N-[3-nitro-5-(3-pyridyloxy)phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C17H12F3N5O4 MolecularWeight: 407.30349

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)C(=O)NC2=CC(=CC(=C2)OC3=CN=CC=C3)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CN1C(=CC(=N1)C(=O)NC2=CC(=CC(=C2)OC3=CN=CC=C3)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C17H12F3N5O4/c1-24-15(17(18,19)20)8-14(23-24)16(26)22-10-5-11(25(27)28)7-13(6-10)29-12-3-2-4-21-9-12/h2-9H,1H3,(H,22,26)