5-[5-(4-methoxyphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[5-(4-methoxyphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-5-[5-(4-methoxyphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzoic acid CAS Name: 2-hydroxy-5-[5-(4-methoxyphenyl)-3-(trifluoromethyl)-1-pyrazolyl]benzoic acid IUPAC Name: 2-hydroxy-5-[5-(4-methoxyphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzoic acid Traditional Name: 2-hydroxy-5-[5-(4-methoxyphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzoic acid Formula: C18H13F3N2O4 MolecularWeight: 378.30203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NN2C3=CC(=C(C=C3)O)C(=O)O)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NN2C3=CC(=C(C=C3)O)C(=O)O)C(F)(F)F

InChI

InChI=1S/C18H13F3N2O4/c1-27-12-5-2-10(3-6-12)14-9-16(18(19,20)21)22-23(14)11-4-7-15(24)13(8-11)17(25)26/h2-9,24H,1H3,(H,25,26)