(4-bromanyl-2-fluoranyl-phenyl) 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl) 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: (4-bromo-2-fluoro-phenyl) 1-isopropylpyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-propan-2-yl-5-pyrazolo[3,4-b]pyridinecarboxylic acid (4-bromo-2-fluorophenyl) ester IUPAC Name: (4-bromo-2-fluorophenyl) 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-isopropylpyrazolo[3,4-b]pyridine-5-carboxylic acid (4-bromo-2-fluoro-phenyl) ester Formula: C16H13BrFN3O2 MolecularWeight: 378.195723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=NC=C(C=C2C=N1)C(=O)OC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CC(C)N1C2=NC=C(C=C2C=N1)C(=O)OC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C16H13BrFN3O2/c1-9(2)21-15-10(8-20-21)5-11(7-19-15)16(22)23-14-4-3-12(17)6-13(14)18/h3-9H,1-2H3