[2-(propoxymethyl)-3-(2-pyridin-3-ylethanoyloxy)-2H-purin-1-yl] 2-pyridin-3-ylethanoate

Systemtic Name: [2-(propoxymethyl)-3-(2-pyridin-3-ylethanoyloxy)-2H-purin-1-yl] 2-pyridin-3-ylethanoate Openeye Name: [2-(propoxymethyl)-3-[2-(3-pyridyl)acetyl]oxy-2H-purin-1-yl] 2-(3-pyridyl)acetate CAS Name: 2-(3-pyridinyl)acetic acid [3-[1-oxo-2-(3-pyridinyl)ethoxy]-2-(propoxymethyl)-2H-purin-1-yl] ester IUPAC Name: [2-(propoxymethyl)-3-(2-pyridin-3-ylacetyl)oxy-2H-purin-1-yl] 2-pyridin-3-ylacetate Traditional Name: 2-(3-pyridyl)acetic acid [2-(propoxymethyl)-3-[2-(3-pyridyl)acetyl]oxy-2H-purin-1-yl] ester Formula: C23H24N6O5 MolecularWeight: 464.47386

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Descriptors Computed from Structure

Canonical SMILES:

CCCOCC1N(C=C2C(=NC=N2)N1OC(=O)CC3=CN=CC=C3)OC(=O)CC4=CN=CC=C4

Isomeric SMILES

CCCOCC1N(C=C2C(=NC=N2)N1OC(=O)CC3=CN=CC=C3)OC(=O)CC4=CN=CC=C4

InChI

InChI=1S/C23H24N6O5/c1-2-9-32-15-20-28(33-21(30)10-17-5-3-7-24-12-17)14-19-23(27-16-26-19)29(20)34-22(31)11-18-6-4-8-25-13-18/h3-8,12-14,16,20H,2,9-11,15H2,1H3