tert-butyl (3R)-3-[6-(3-ethoxy-3-oxidanylidene-propyl)-5-methyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidin-2-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl (3R)-3-[6-(3-ethoxy-3-oxidanylidene-propyl)-5-methyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidin-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl (3R)-3-[6-(3-ethoxy-3-oxo-propyl)-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-2-yl]piperidine-1-carboxylate CAS Name: (3R)-3-[6-(3-ethoxy-3-oxopropyl)-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-2-yl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-3-[6-(3-ethoxy-3-oxopropyl)-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-2-yl]piperidine-1-carboxylate Traditional Name: (3R)-3-[6-(3-ethoxy-3-keto-propyl)-7-keto-5-methyl-1H-pyrazolo[1,5-a]pyrimidin-2-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H32N4O5 MolecularWeight: 432.51328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(N=C2C=C(NN2C1=O)C3CCCN(C3)C(=O)OC(C)(C)C)C

Isomeric SMILES

CCOC(=O)CCC1=C(N=C2C=C(NN2C1=O)[C@@H]3CCCN(C3)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C22H32N4O5/c1-6-30-19(27)10-9-16-14(2)23-18-12-17(24-26(18)20(16)28)15-8-7-11-25(13-15)21(29)31-22(3,4)5/h12,15,24H,6-11,13H2,1-5H3/t15-/m1/s1