(phenylmethyl) 2-(7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidin-5-yl)pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-(7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidin-5-yl)pyrrolidine-1-carboxylate Openeye Name: benzyl 2-(7-oxo-1H-pyrazolo[1,5-a]pyrimidin-5-yl)pyrrolidine-1-carboxylate CAS Name: 2-(7-oxo-1H-pyrazolo[1,5-a]pyrimidin-5-yl)-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(7-oxo-1H-pyrazolo[1,5-a]pyrimidin-5-yl)pyrrolidine-1-carboxylate Traditional Name: 2-(7-keto-1H-pyrazolo[1,5-a]pyrimidin-5-yl)pyrrolidine-1-carboxylic acid benzyl ester Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O3/c23-17-11-14(20-16-8-9-19-22(16)17)15-7-4-10-21(15)18(24)25-12-13-5-2-1-3-6-13/h1-3,5-6,8-9,11,15,19H,4,7,10,12H2