5-phenyl-1-[2-(trifluoromethyl)phenyl]pyrazole-3,4-dicarboxylic acid

Systemtic Name: 5-phenyl-1-[2-(trifluoromethyl)phenyl]pyrazole-3,4-dicarboxylic acid Openeye Name: 5-phenyl-1-[2-(trifluoromethyl)phenyl]pyrazole-3,4-dicarboxylic acid CAS Name: 5-phenyl-1-[2-(trifluoromethyl)phenyl]pyrazole-3,4-dicarboxylic acid IUPAC Name: 5-phenyl-1-[2-(trifluoromethyl)phenyl]pyrazole-3,4-dicarboxylic acid Traditional Name: 5-phenyl-1-[2-(trifluoromethyl)phenyl]pyrazole-3,4-dicarboxylic acid Formula: C18H11F3N2O4 MolecularWeight: 376.28615

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=NN2C3=CC=CC=C3C(F)(F)F)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=NN2C3=CC=CC=C3C(F)(F)F)C(=O)O)C(=O)O

InChI

InChI=1S/C18H11F3N2O4/c19-18(20,21)11-8-4-5-9-12(11)23-15(10-6-2-1-3-7-10)13(16(24)25)14(22-23)17(26)27/h1-9H,(H,24,25)(H,26,27)