5-phenyl-3-(2-phenylpropyl)-1-[2-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid

Systemtic Name: 5-phenyl-3-(2-phenylpropyl)-1-[2-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid Openeye Name: 5-phenyl-3-(2-phenylpropyl)-1-[2-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid CAS Name: 5-phenyl-3-(2-phenylpropyl)-1-[2-(trifluoromethyl)phenyl]-4-pyrazolecarboxylic acid IUPAC Name: 5-phenyl-3-(2-phenylpropyl)-1-[2-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid Traditional Name: 5-phenyl-3-(2-phenylpropyl)-1-[2-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid Formula: C26H21F3N2O2 MolecularWeight: 450.45235

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=NN(C(=C1C(=O)O)C2=CC=CC=C2)C3=CC=CC=C3C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

CC(CC1=NN(C(=C1C(=O)O)C2=CC=CC=C2)C3=CC=CC=C3C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C26H21F3N2O2/c1-17(18-10-4-2-5-11-18)16-21-23(25(32)33)24(19-12-6-3-7-13-19)31(30-21)22-15-9-8-14-20(22)26(27,28)29/h2-15,17H,16H2,1H3,(H,32,33)