phenacyl 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: phenacyl 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: phenacyl 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-isopropyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinecarboxylic acid phenacyl ester IUPAC Name: phenacyl 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-isopropyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid phenacyl ester Formula: C26H23N3O5 MolecularWeight: 457.47792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3=CC4=C(C=C3)OCCO4)C(=O)OCC(=O)C5=CC=CC=C5

Isomeric SMILES

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3=CC4=C(C=C3)OCCO4)C(=O)OCC(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H23N3O5/c1-16(2)29-25-20(14-27-29)19(26(31)34-15-22(30)17-6-4-3-5-7-17)13-21(28-25)18-8-9-23-24(12-18)33-11-10-32-23/h3-9,12-14,16H,10-11,15H2,1-2H3