N-[4-[3,5-bis(trifluoromethyl)pyrazol-1-yl]phenyl]-1-methyl-5-nitro-pyrazole-4-carboxamide

Systemtic Name: N-[4-[3,5-bis(trifluoromethyl)pyrazol-1-yl]phenyl]-1-methyl-5-nitro-pyrazole-4-carboxamide Openeye Name: N-[4-[3,5-bis(trifluoromethyl)pyrazol-1-yl]phenyl]-1-methyl-5-nitro-pyrazole-4-carboxamide CAS Name: N-[4-[3,5-bis(trifluoromethyl)-1-pyrazolyl]phenyl]-1-methyl-5-nitro-4-pyrazolecarboxamide IUPAC Name: N-[4-[3,5-bis(trifluoromethyl)pyrazol-1-yl]phenyl]-1-methyl-5-nitropyrazole-4-carboxamide Traditional Name: N-[4-[3,5-bis(trifluoromethyl)pyrazol-1-yl]phenyl]-1-methyl-5-nitro-pyrazole-4-carboxamide Formula: C16H10F6N6O3 MolecularWeight: 448.279419

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)NC2=CC=C(C=C2)N3C(=CC(=N3)C(F)(F)F)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CN1C(=C(C=N1)C(=O)NC2=CC=C(C=C2)N3C(=CC(=N3)C(F)(F)F)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H10F6N6O3/c1-26-14(28(30)31)10(7-23-26)13(29)24-8-2-4-9(5-3-8)27-12(16(20,21)22)6-11(25-27)15(17,18)19/h2-7H,1H3,(H,24,29)