ethyl 4-(2-chlorophenyl)-1-ethanoyl-6-propyl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: ethyl 4-(2-chlorophenyl)-1-ethanoyl-6-propyl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 1-acetyl-4-(2-chlorophenyl)-6-propyl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-acetyl-4-(2-chlorophenyl)-6-propyl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 1-acetyl-4-(2-chlorophenyl)-6-propyl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-acetyl-4-(2-chlorophenyl)-6-propyl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C20H22ClN3O3 MolecularWeight: 387.85998

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(C2=CNN(C2=N1)C(=O)C)C3=CC=CC=C3Cl)C(=O)OCC

Isomeric SMILES

CCCC1=C(C(C2=CNN(C2=N1)C(=O)C)C3=CC=CC=C3Cl)C(=O)OCC

InChI

InChI=1S/C20H22ClN3O3/c1-4-8-16-18(20(26)27-5-2)17(13-9-6-7-10-15(13)21)14-11-22-24(12(3)25)19(14)23-16/h6-7,9-11,17,22H,4-5,8H2,1-3H3