ethyl 3-(4-chlorophenyl)-6-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: ethyl 3-(4-chlorophenyl)-6-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 3-(4-chlorophenyl)-6-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 3-(4-chlorophenyl)-6-methyl-1-phenyl-5-pyrazolo[3,4-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-chlorophenyl)-6-methyl-1-phenylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 3-(4-chlorophenyl)-6-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C22H18ClN3O2 MolecularWeight: 391.85022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2C(=C1)C(=NN2C3=CC=CC=C3)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N=C2C(=C1)C(=NN2C3=CC=CC=C3)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C22H18ClN3O2/c1-3-28-22(27)18-13-19-20(15-9-11-16(23)12-10-15)25-26(21(19)24-14(18)2)17-7-5-4-6-8-17/h4-13H,3H2,1-2H3