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

Systemtic Name: 5-methyl-1-phenyl-3-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid Openeye Name: 5-methyl-1-phenyl-3-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid CAS Name: 5-methyl-1-phenyl-3-[4-(trifluoromethyl)phenyl]-4-pyrazolecarboxylic acid IUPAC Name: 5-methyl-1-phenyl-3-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid Traditional Name: 5-methyl-1-phenyl-3-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid Formula: C18H13F3N2O2 MolecularWeight: 346.30323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C3=CC=C(C=C3)C(F)(F)F)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C3=CC=C(C=C3)C(F)(F)F)C(=O)O

InChI

InChI=1S/C18H13F3N2O2/c1-11-15(17(24)25)16(22-23(11)14-5-3-2-4-6-14)12-7-9-13(10-8-12)18(19,20)21/h2-10H,1H3,(H,24,25)