[5-(4-acetamido-3-cyano-pyrazolo[3,4-d]pyrimidin-2-yl)-3,4-diacetyloxy-oxolan-2-yl]methyl ethanoate

Systemtic Name: [5-(4-acetamido-3-cyano-pyrazolo[3,4-d]pyrimidin-2-yl)-3,4-diacetyloxy-oxolan-2-yl]methyl ethanoate Openeye Name: [5-(4-acetamido-3-cyano-pyrazolo[3,4-d]pyrimidin-2-yl)-3,4-diacetoxy-tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [5-(4-acetamido-3-cyano-2-pyrazolo[3,4-d]pyrimidinyl)-3,4-diacetyloxy-2-oxolanyl]methyl ester IUPAC Name: [5-(4-acetamido-3-cyanopyrazolo[3,4-d]pyrimidin-2-yl)-3,4-diacetyloxyoxolan-2-yl]methyl acetate Traditional Name: acetic acid [5-(4-acetamido-3-cyano-pyrazolo[3,4-d]pyrimidin-2-yl)-3,4-diacetoxy-tetrahydrofuran-2-yl]methyl ester Formula: C19H20N6O8 MolecularWeight: 460.3975

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC=NC2=NN(C(=C21)C#N)C3C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)NC1=NC=NC2=NN(C(=C21)C#N)C3C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C19H20N6O8/c1-8(26)23-17-14-12(5-20)25(24-18(14)22-7-21-17)19-16(32-11(4)29)15(31-10(3)28)13(33-19)6-30-9(2)27/h7,13,15-16,19H,6H2,1-4H3,(H,21,22,23,24,26)