N-[2-acetamido-9-[oxidanyl(3-oxidanylpropoxy)methyl]purin-6-yl]ethanamide

Systemtic Name: N-[2-acetamido-9-[oxidanyl(3-oxidanylpropoxy)methyl]purin-6-yl]ethanamide Openeye Name: N-[2-acetamido-9-[hydroxy(3-hydroxypropoxy)methyl]purin-6-yl]acetamide CAS Name: N-[2-acetamido-9-[hydroxy(3-hydroxypropoxy)methyl]-6-purinyl]acetamide IUPAC Name: N-[2-acetamido-9-[hydroxy(3-hydroxypropoxy)methyl]purin-6-yl]acetamide Traditional Name: N-[2-acetamido-9-[hydroxy(3-hydroxypropoxy)methyl]purin-6-yl]acetamide Formula: C13H18N6O5 MolecularWeight: 338.31922

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=NC2=C1N=CN2C(O)OCCCO)NC(=O)C

Isomeric SMILES

CC(=O)NC1=NC(=NC2=C1N=CN2C(O)OCCCO)NC(=O)C

InChI

InChI=1S/C13H18N6O5/c1-7(21)15-10-9-11(18-12(17-10)16-8(2)22)19(6-14-9)13(23)24-5-3-4-20/h6,13,20,23H,3-5H2,1-2H3,(H2,15,16,17,18,21,22)