6-cyclopropyl-3-methyl-1-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: 6-cyclopropyl-3-methyl-1-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: 6-cyclopropyl-1-[2-(isopropylamino)-2-oxo-ethyl]-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 6-cyclopropyl-3-methyl-1-[2-oxo-2-(propan-2-ylamino)ethyl]-4-pyrazolo[3,4-b]pyridinecarboxylate IUPAC Name: 6-cyclopropyl-3-methyl-1-[2-oxo-2-(propan-2-ylamino)ethyl]pyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 6-cyclopropyl-1-[2-(isopropylamino)-2-keto-ethyl]-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate Formula: C16H19N4O3- MolecularWeight: 315.34706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3CC3)C(=O)[O-])CC(=O)NC(C)C

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3CC3)C(=O)[O-])CC(=O)NC(C)C

InChI

InChI=1S/C16H20N4O3/c1-8(2)17-13(21)7-20-15-14(9(3)19-20)11(16(22)23)6-12(18-15)10-4-5-10/h6,8,10H,4-5,7H2,1-3H3,(H,17,21)(H,22,23)/p-1