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

Systemtic Name: (3-methoxycarbonylphenyl)methyl 1,6-di(propan-2-yl)pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: (3-methoxycarbonylphenyl)methyl 1,6-diisopropylpyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 1,6-di(propan-2-yl)-4-pyrazolo[3,4-b]pyridinecarboxylic acid (3-methoxycarbonylphenyl)methyl ester IUPAC Name: (3-methoxycarbonylphenyl)methyl 1,6-di(propan-2-yl)pyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1,6-diisopropylpyrazolo[3,4-b]pyridine-4-carboxylic acid (3-carbomethoxybenzyl) ester Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(C=NN2C(C)C)C(=C1)C(=O)OCC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

CC(C)C1=NC2=C(C=NN2C(C)C)C(=C1)C(=O)OCC3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C22H25N3O4/c1-13(2)19-10-17(18-11-23-25(14(3)4)20(18)24-19)22(27)29-12-15-7-6-8-16(9-15)21(26)28-5/h6-11,13-14H,12H2,1-5H3