methyl 1-[(3-fluorophenyl)methyl]-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: methyl 1-[(3-fluorophenyl)methyl]-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: methyl 1-[(3-fluorophenyl)methyl]-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 1-[(3-fluorophenyl)methyl]-6-phenyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(3-fluorophenyl)methyl]-6-phenylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1-(3-fluorobenzyl)-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid methyl ester Formula: C21H16FN3O2 MolecularWeight: 361.369043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=NC2=C1C=NN2CC3=CC(=CC=C3)F)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC(=NC2=C1C=NN2CC3=CC(=CC=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C21H16FN3O2/c1-27-21(26)17-11-19(15-7-3-2-4-8-15)24-20-18(17)12-23-25(20)13-14-6-5-9-16(22)10-14/h2-12H,13H2,1H3