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

Systemtic Name: 4-phenyl-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylic acid Openeye Name: 4-phenyl-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylic acid CAS Name: 4-phenyl-1-[3-(trifluoromethyl)phenyl]-3-pyrazolecarboxylic acid IUPAC Name: 4-phenyl-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylic acid Traditional Name: 4-phenyl-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylic acid Formula: C17H11F3N2O2 MolecularWeight: 332.27665

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(N=C2C(=O)O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(N=C2C(=O)O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C17H11F3N2O2/c18-17(19,20)12-7-4-8-13(9-12)22-10-14(15(21-22)16(23)24)11-5-2-1-3-6-11/h1-10H,(H,23,24)