(2-chloranyl-6-fluoranyl-phenyl)methyl 6-methyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 6-methyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 1-isopropyl-6-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 6-methyl-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinecarboxylic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1-isopropyl-6-methyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid (2-chloro-6-fluoro-benzyl) ester Formula: C18H17ClFN3O2 MolecularWeight: 361.797883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2C(C)C)C(=C1)C(=O)OCC3=C(C=CC=C3Cl)F

Isomeric SMILES

CC1=NC2=C(C=NN2C(C)C)C(=C1)C(=O)OCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C18H17ClFN3O2/c1-10(2)23-17-13(8-21-23)12(7-11(3)22-17)18(24)25-9-14-15(19)5-4-6-16(14)20/h4-8,10H,9H2,1-3H3