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

Systemtic Name: ethyl 4-(2-chlorophenyl)-3-methyl-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 4-(2-chlorophenyl)-3-methyl-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 4-(2-chlorophenyl)-3-methyl-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-chlorophenyl)-3-methyl-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 4-(2-chlorophenyl)-3-methyl-6-propyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C19H22ClN3O2 MolecularWeight: 359.84988

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(C2=C(NNC2=N1)C)C3=CC=CC=C3Cl)C(=O)OCC

Isomeric SMILES

CCCC1=C(C(C2=C(NNC2=N1)C)C3=CC=CC=C3Cl)C(=O)OCC

InChI

InChI=1S/C19H22ClN3O2/c1-4-8-14-17(19(24)25-5-2)16(12-9-6-7-10-13(12)20)15-11(3)22-23-18(15)21-14/h6-7,9-10,16H,4-5,8H2,1-3H3,(H2,21,22,23)