(2-oxidanylideneazepan-3-yl) 6-methyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: (2-oxidanylideneazepan-3-yl) 6-methyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: (2-oxoazepan-3-yl) 1-isopropyl-6-methyl-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 6-methyl-1-propan-2-yl-5-pyrazolo[3,4-b]pyridinecarboxylic acid (2-oxo-3-azepanyl) ester IUPAC Name: (2-oxoazepan-3-yl) 6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-isopropyl-6-methyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid (2-ketoazepan-3-yl) ester Formula: C17H22N4O3 MolecularWeight: 330.38158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=NN(C2=N1)C(C)C)C(=O)OC3CCCCNC3=O

Isomeric SMILES

CC1=C(C=C2C=NN(C2=N1)C(C)C)C(=O)OC3CCCCNC3=O

InChI

InChI=1S/C17H22N4O3/c1-10(2)21-15-12(9-19-21)8-13(11(3)20-15)17(23)24-14-6-4-5-7-18-16(14)22/h8-10,14H,4-7H2,1-3H3,(H,18,22)