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

Systemtic Name: (3-methylphenyl)methyl 3,6-dimethyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: m-tolylmethyl 3,6-dimethyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 3,6-dimethyl-1-phenyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid (3-methylphenyl)methyl ester IUPAC Name: (3-methylphenyl)methyl 3,6-dimethyl-1-phenylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 3,6-dimethyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid (3-methylbenzyl) ester Formula: C23H21N3O2 MolecularWeight: 371.43174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC(=O)C2=CC(=NC3=C2C(=NN3C4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC(=CC=C1)COC(=O)C2=CC(=NC3=C2C(=NN3C4=CC=CC=C4)C)C

InChI

InChI=1S/C23H21N3O2/c1-15-8-7-9-18(12-15)14-28-23(27)20-13-16(2)24-22-21(20)17(3)25-26(22)19-10-5-4-6-11-19/h4-13H,14H2,1-3H3