7-(3-fluoranyl-5-methoxy-phenyl)-5-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid

Systemtic Name: 7-(3-fluoranyl-5-methoxy-phenyl)-5-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Openeye Name: 7-(3-fluoro-5-methoxy-phenyl)-5-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid CAS Name: 7-(3-fluoro-5-methoxyphenyl)-5-(3-methoxyphenyl)-2-pyrazolo[1,5-a]pyrimidinecarboxylic acid IUPAC Name: 7-(3-fluoro-5-methoxyphenyl)-5-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Traditional Name: 7-(3-fluoro-5-methoxy-phenyl)-5-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Formula: C21H16FN3O4 MolecularWeight: 393.367843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NC3=CC(=NN3C(=C2)C4=CC(=CC(=C4)F)OC)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C2=NC3=CC(=NN3C(=C2)C4=CC(=CC(=C4)F)OC)C(=O)O

InChI

InChI=1S/C21H16FN3O4/c1-28-15-5-3-4-12(7-15)17-10-19(13-6-14(22)9-16(8-13)29-2)25-20(23-17)11-18(24-25)21(26)27/h3-11H,1-2H3,(H,26,27)