(2-oxidanylideneazepan-3-yl) 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: (2-oxidanylideneazepan-3-yl) 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: (2-oxoazepan-3-yl) 1-isopropylpyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-propan-2-yl-5-pyrazolo[3,4-b]pyridinecarboxylic acid (2-oxo-3-azepanyl) ester IUPAC Name: (2-oxoazepan-3-yl) 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-isopropylpyrazolo[3,4-b]pyridine-5-carboxylic acid (2-ketoazepan-3-yl) ester Formula: C16H20N4O3 MolecularWeight: 316.355

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=NC=C(C=C2C=N1)C(=O)OC3CCCCNC3=O

Isomeric SMILES

CC(C)N1C2=NC=C(C=C2C=N1)C(=O)OC3CCCCNC3=O

InChI

InChI=1S/C16H20N4O3/c1-10(2)20-14-11(9-19-20)7-12(8-18-14)16(22)23-13-5-3-4-6-17-15(13)21/h7-10,13H,3-6H2,1-2H3,(H,17,21)