(4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl 2-chloranylethanoate

Systemtic Name: (4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl 2-chloranylethanoate Openeye Name: (4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl 2-chloroacetate CAS Name: 2-chloroacetic acid (4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl ester IUPAC Name: (4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl 2-chloroacetate Traditional Name: 2-chloroacetic acid (4-keto-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl ester Formula: C8H7ClN4O3 MolecularWeight: 242.61918

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=NC=NC2=O)N(N1)COC(=O)CCl

Isomeric SMILES

C1=C2C(=NC=NC2=O)N(N1)COC(=O)CCl

InChI

InChI=1S/C8H7ClN4O3/c9-1-6(14)16-4-13-7-5(2-12-13)8(15)11-3-10-7/h2-3,12H,1,4H2