(2-chloranyl-4-fluoranyl-phenyl)methyl 6-methyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl)methyl 6-methyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: (2-chloro-4-fluoro-phenyl)methyl 1-isopropyl-6-methyl-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 6-methyl-1-propan-2-yl-5-pyrazolo[3,4-b]pyridinecarboxylic acid (2-chloro-4-fluorophenyl)methyl ester IUPAC Name: (2-chloro-4-fluorophenyl)methyl 6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-isopropyl-6-methyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid (2-chloro-4-fluoro-benzyl) ester Formula: C18H17ClFN3O2 MolecularWeight: 361.797883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=NN(C2=N1)C(C)C)C(=O)OCC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CC1=C(C=C2C=NN(C2=N1)C(C)C)C(=O)OCC3=C(C=C(C=C3)F)Cl

InChI

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