7-(4-chlorophenyl)-5-(2-phenylmethoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid

Systemtic Name: 7-(4-chlorophenyl)-5-(2-phenylmethoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Openeye Name: 5-(2-benzyloxyphenyl)-7-(4-chlorophenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid CAS Name: 7-(4-chlorophenyl)-5-(2-phenylmethoxyphenyl)-2-pyrazolo[1,5-a]pyrimidinecarboxylic acid IUPAC Name: 7-(4-chlorophenyl)-5-(2-phenylmethoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Traditional Name: 5-(2-benzoxyphenyl)-7-(4-chlorophenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Formula: C26H18ClN3O3 MolecularWeight: 455.89242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC=C2C3=NC4=CC(=NN4C(=C3)C5=CC=C(C=C5)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC=C2C3=NC4=CC(=NN4C(=C3)C5=CC=C(C=C5)Cl)C(=O)O

InChI

InChI=1S/C26H18ClN3O3/c27-19-12-10-18(11-13-19)23-14-21(28-25-15-22(26(31)32)29-30(23)25)20-8-4-5-9-24(20)33-16-17-6-2-1-3-7-17/h1-15H,16H2,(H,31,32)