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

Systemtic Name: (4-aminocarbonylphenyl)methyl 6-cyclopropyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: (4-carbamoylphenyl)methyl 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 (4-carbamoylphenyl)methyl ester IUPAC Name: (4-carbamoylphenyl)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 (4-carbamoylbenzyl) ester Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3CC3)C(=O)OCC4=CC=C(C=C4)C(=O)N

Isomeric SMILES

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3CC3)C(=O)OCC4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C21H22N4O3/c1-12(2)25-20-17(10-23-25)16(9-18(24-20)14-7-8-14)21(27)28-11-13-3-5-15(6-4-13)19(22)26/h3-6,9-10,12,14H,7-8,11H2,1-2H3,(H2,22,26)