1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxylate

Systemtic Name: 1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxylate Openeye Name: 1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxylate CAS Name: 1-phenyl-5-(trifluoromethyl)-4-pyrazolecarboxylate IUPAC Name: 1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxylate Traditional Name: 1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxylate Formula: C11H6F3N2O2- MolecularWeight: 255.17275

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H7F3N2O2/c12-11(13,14)9-8(10(17)18)6-15-16(9)7-4-2-1-3-5-7/h1-6H,(H,17,18)/p-1