N-[3,5-bis(trifluoromethyl)phenyl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-2,5-dimethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-2,5-dimethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Formula: C14H10F6N4O3 MolecularWeight: 396.244619

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C

InChI

InChI=1S/C14H10F6N4O3/c1-6-10(24(26)27)11(23(2)22-6)12(25)21-9-4-7(13(15,16)17)3-8(5-9)14(18,19)20/h3-5H,1-2H3,(H,21,25)