ethyl 4-chloranyl-1,3-diphenyl-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: ethyl 4-chloranyl-1,3-diphenyl-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 4-chloro-1,3-diphenyl-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 4-chloro-1,3-diphenyl-5-pyrazolo[3,4-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-chloro-1,3-diphenylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 4-chloro-1,3-diphenyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C21H16ClN3O2 MolecularWeight: 377.82364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1Cl)C(=NN2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1Cl)C(=NN2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H16ClN3O2/c1-2-27-21(26)16-13-23-20-17(18(16)22)19(14-9-5-3-6-10-14)24-25(20)15-11-7-4-8-12-15/h3-13H,2H2,1H3