N-[9-[1,4-bis(oxidanyl)butan-2-yl]purin-6-yl]ethanamide

Systemtic Name: N-[9-[1,4-bis(oxidanyl)butan-2-yl]purin-6-yl]ethanamide Openeye Name: N-[9-[3-hydroxy-1-(hydroxymethyl)propyl]purin-6-yl]acetamide CAS Name: N-[9-(1,4-dihydroxybutan-2-yl)-6-purinyl]acetamide IUPAC Name: N-[9-(1,4-dihydroxybutan-2-yl)purin-6-yl]acetamide Traditional Name: N-[9-(3-hydroxy-1-methylol-propyl)purin-6-yl]acetamide Formula: C11H15N5O3 MolecularWeight: 265.2685

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC=NC2=C1N=CN2C(CCO)CO

Isomeric SMILES

CC(=O)NC1=NC=NC2=C1N=CN2C(CCO)CO

InChI

InChI=1S/C11H15N5O3/c1-7(19)15-10-9-11(13-5-12-10)16(6-14-9)8(4-18)2-3-17/h5-6,8,17-18H,2-4H2,1H3,(H,12,13,15,19)