[4-(4-chlorophenyl)carbonylphenyl] 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: [4-(4-chlorophenyl)carbonylphenyl] 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: [4-(4-chlorobenzoyl)phenyl] 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1,3-dimethyl-5-pyrazolo[3,4-b]pyridinecarboxylic acid [4-[(4-chlorophenyl)-oxomethyl]phenyl] ester IUPAC Name: [4-(4-chlorobenzoyl)phenyl] 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid [4-(4-chlorobenzoyl)phenyl] ester Formula: C22H16ClN3O3 MolecularWeight: 405.83374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C=C12)C(=O)OC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1=NN(C2=NC=C(C=C12)C(=O)OC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C22H16ClN3O3/c1-13-19-11-16(12-24-21(19)26(2)25-13)22(28)29-18-9-5-15(6-10-18)20(27)14-3-7-17(23)8-4-14/h3-12H,1-2H3