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

Systemtic Name: (3-methoxycarbonylphenyl)methyl 6-cyclopropyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: (3-methoxycarbonylphenyl)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 (3-methoxycarbonylphenyl)methyl ester IUPAC Name: (3-methoxycarbonylphenyl)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-carbomethoxybenzyl) ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O4/c1-13(2)25-20-18(11-23-25)17(10-19(24-20)15-7-8-15)22(27)29-12-14-5-4-6-16(9-14)21(26)28-3/h4-6,9-11,13,15H,7-8,12H2,1-3H3