1-[2-nitro-4-(trifluoromethyl)phenyl]pyrazole-4-carboxylate

Systemtic Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]pyrazole-4-carboxylate Openeye Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]pyrazole-4-carboxylate CAS Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-4-pyrazolecarboxylate IUPAC Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]pyrazole-4-carboxylate Traditional Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]pyrazole-4-carboxylate Formula: C11H5F3N3O4- MolecularWeight: 300.17031

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])N2C=C(C=N2)C(=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])N2C=C(C=N2)C(=O)[O-]

InChI

InChI=1S/C11H6F3N3O4/c12-11(13,14)7-1-2-8(9(3-7)17(20)21)16-5-6(4-15-16)10(18)19/h1-5H,(H,18,19)/p-1