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

Systemtic Name: 2-hydroxyethyl 1-[(4-chlorophenyl)methyl]-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: 2-hydroxyethyl 1-[(4-chlorophenyl)methyl]-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 1-[(4-chlorophenyl)methyl]-6-phenyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid 2-hydroxyethyl ester IUPAC Name: 2-hydroxyethyl 1-[(4-chlorophenyl)methyl]-6-phenylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1-(4-chlorobenzyl)-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid 2-hydroxyethyl ester Formula: C22H18ClN3O3 MolecularWeight: 407.84962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(C=NN3CC4=CC=C(C=C4)Cl)C(=C2)C(=O)OCCO

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(C=NN3CC4=CC=C(C=C4)Cl)C(=C2)C(=O)OCCO

InChI

InChI=1S/C22H18ClN3O3/c23-17-8-6-15(7-9-17)14-26-21-19(13-24-26)18(22(28)29-11-10-27)12-20(25-21)16-4-2-1-3-5-16/h1-9,12-13,27H,10-11,14H2