methyl 6-(2,4-dichlorophenyl)-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: methyl 6-(2,4-dichlorophenyl)-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: methyl 6-(2,4-dichlorophenyl)-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 6-(2,4-dichlorophenyl)-3-methyl-1-phenyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-(2,4-dichlorophenyl)-3-methyl-1-phenylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 6-(2,4-dichlorophenyl)-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid methyl ester Formula: C21H15Cl2N3O2 MolecularWeight: 412.2687

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=C(C=C(C=C3)Cl)Cl)C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=C(C=C(C=C3)Cl)Cl)C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C21H15Cl2N3O2/c1-12-19-16(21(27)28-2)11-18(15-9-8-13(22)10-17(15)23)24-20(19)26(25-12)14-6-4-3-5-7-14/h3-11H,1-2H3