(3-methylphenyl)methyl 6-cyclopropyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: (3-methylphenyl)methyl 6-cyclopropyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: m-tolylmethyl 6-cyclopropyl-1-isopropyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 6-cyclopropyl-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinecarboxylic acid (3-methylphenyl)methyl ester IUPAC Name: (3-methylphenyl)methyl 6-cyclopropyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 6-cyclopropyl-1-isopropyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid (3-methylbenzyl) ester Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC(=O)C2=CC(=NC3=C2C=NN3C(C)C)C4CC4

Isomeric SMILES

CC1=CC(=CC=C1)COC(=O)C2=CC(=NC3=C2C=NN3C(C)C)C4CC4

InChI

InChI=1S/C21H23N3O2/c1-13(2)24-20-18(11-22-24)17(10-19(23-20)16-7-8-16)21(25)26-12-15-6-4-5-14(3)9-15/h4-6,9-11,13,16H,7-8,12H2,1-3H3