(phenylmethyl) 3-(7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidin-5-yl)piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 3-(7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidin-5-yl)piperidine-1-carboxylate Openeye Name: benzyl 3-(7-oxo-1H-pyrazolo[1,5-a]pyrimidin-5-yl)piperidine-1-carboxylate CAS Name: 3-(7-oxo-1H-pyrazolo[1,5-a]pyrimidin-5-yl)-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(7-oxo-1H-pyrazolo[1,5-a]pyrimidin-5-yl)piperidine-1-carboxylate Traditional Name: 3-(7-keto-1H-pyrazolo[1,5-a]pyrimidin-5-yl)piperidine-1-carboxylic acid benzyl ester Formula: C19H20N4O3 MolecularWeight: 352.3871

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)OCC2=CC=CC=C2)C3=CC(=O)N4C(=N3)C=CN4

Isomeric SMILES

C1CC(CN(C1)C(=O)OCC2=CC=CC=C2)C3=CC(=O)N4C(=N3)C=CN4

InChI

InChI=1S/C19H20N4O3/c24-18-11-16(21-17-8-9-20-23(17)18)15-7-4-10-22(12-15)19(25)26-13-14-5-2-1-3-6-14/h1-3,5-6,8-9,11,15,20H,4,7,10,12-13H2