4-methanoyl-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylic acid

Systemtic Name: 4-methanoyl-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylic acid Openeye Name: 4-formyl-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylic acid CAS Name: 4-formyl-1-[3-(trifluoromethyl)phenyl]-3-pyrazolecarboxylic acid IUPAC Name: 4-formyl-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylic acid Traditional Name: 4-formyl-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylic acid Formula: C12H7F3N2O3 MolecularWeight: 284.19079

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C=C(C(=N2)C(=O)O)C=O)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)N2C=C(C(=N2)C(=O)O)C=O)C(F)(F)F

InChI

InChI=1S/C12H7F3N2O3/c13-12(14,15)8-2-1-3-9(4-8)17-5-7(6-18)10(16-17)11(19)20/h1-6H,(H,19,20)