[2-(6-methylheptan-2-ylamino)-2-oxidanylidene-ethyl] 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: [2-(6-methylheptan-2-ylamino)-2-oxidanylidene-ethyl] 1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: [2-(1,5-dimethylhexylamino)-2-oxo-ethyl] 1-isopropylpyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-propan-2-yl-5-pyrazolo[3,4-b]pyridinecarboxylic acid [2-(6-methylheptan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(6-methylheptan-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-(1,5-dimethylhexylamino)-2-keto-ethyl] ester Formula: C20H30N4O3 MolecularWeight: 374.4772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC(=O)COC(=O)C1=CN=C2C(=C1)C=NN2C(C)C

Isomeric SMILES

CC(C)CCCC(C)NC(=O)COC(=O)C1=CN=C2C(=C1)C=NN2C(C)C

InChI

InChI=1S/C20H30N4O3/c1-13(2)7-6-8-15(5)23-18(25)12-27-20(26)17-9-16-11-22-24(14(3)4)19(16)21-10-17/h9-11,13-15H,6-8,12H2,1-5H3,(H,23,25)