[2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: [2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: [2-oxo-2-(sec-butylamino)ethyl] 1-isopropylpyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-propan-2-yl-5-pyrazolo[3,4-b]pyridinecarboxylic acid [2-(butan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(butan-2-ylamino)-2-oxoethyl] 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-isopropylpyrazolo[3,4-b]pyridine-5-carboxylic acid [2-keto-2-(sec-butylamino)ethyl] ester Formula: C16H22N4O3 MolecularWeight: 318.37088

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)C1=CN=C2C(=C1)C=NN2C(C)C

Isomeric SMILES

CCC(C)NC(=O)COC(=O)C1=CN=C2C(=C1)C=NN2C(C)C

InChI

InChI=1S/C16H22N4O3/c1-5-11(4)19-14(21)9-23-16(22)13-6-12-8-18-20(10(2)3)15(12)17-7-13/h6-8,10-11H,5,9H2,1-4H3,(H,19,21)