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

Systemtic Name: (4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl 2-azanyl-2-phenyl-ethanoate Openeye Name: (4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl 2-amino-2-phenyl-acetate CAS Name: 2-amino-2-phenylacetic 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-amino-2-phenylacetate Traditional Name: 2-amino-2-phenyl-acetic acid (4-keto-2H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl ester Formula: C14H13N5O3 MolecularWeight: 299.28472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)OCN2C3=NC=NC(=O)C3=CN2)N

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)OCN2C3=NC=NC(=O)C3=CN2)N

InChI

InChI=1S/C14H13N5O3/c15-11(9-4-2-1-3-5-9)14(21)22-8-19-12-10(6-18-19)13(20)17-7-16-12/h1-7,11,18H,8,15H2