ethyl 4-(2-chloranyl-4-fluoranyl-phenyl)-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: ethyl 4-(2-chloranyl-4-fluoranyl-phenyl)-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 4-(2-chloro-4-fluoro-phenyl)-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 4-(2-chloro-4-fluorophenyl)-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-chloro-4-fluorophenyl)-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 4-(2-chloro-4-fluoro-phenyl)-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C18H19ClFN3O2 MolecularWeight: 363.813763

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(C2=CNNC2=N1)C3=C(C=C(C=C3)F)Cl)C(=O)OCC

Isomeric SMILES

CCCC1=C(C(C2=CNNC2=N1)C3=C(C=C(C=C3)F)Cl)C(=O)OCC

InChI

InChI=1S/C18H19ClFN3O2/c1-3-5-14-16(18(24)25-4-2)15(12-9-21-23-17(12)22-14)11-7-6-10(20)8-13(11)19/h6-9,15H,3-5H2,1-2H3,(H2,21,22,23)