6-[8-(hydroxymethyl)-3-methyl-2,6-bis(oxidanylidene)-7H-purin-1-yl]hexan-2-yl ethanoate

Systemtic Name: 6-[8-(hydroxymethyl)-3-methyl-2,6-bis(oxidanylidene)-7H-purin-1-yl]hexan-2-yl ethanoate Openeye Name: [5-[8-(hydroxymethyl)-3-methyl-2,6-dioxo-7H-purin-1-yl]-1-methyl-pentyl] acetate CAS Name: acetic acid 6-[8-(hydroxymethyl)-3-methyl-2,6-dioxo-7H-purin-1-yl]hexan-2-yl ester IUPAC Name: 6-[8-(hydroxymethyl)-3-methyl-2,6-dioxo-7H-purin-1-yl]hexan-2-yl acetate Traditional Name: acetic acid [5-(2,6-diketo-3-methyl-8-methylol-7H-purin-1-yl)-1-methyl-pentyl] ester Formula: C15H22N4O5 MolecularWeight: 338.35898

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCN1C(=O)C2=C(N=C(N2)CO)N(C1=O)C)OC(=O)C

Isomeric SMILES

CC(CCCCN1C(=O)C2=C(N=C(N2)CO)N(C1=O)C)OC(=O)C

InChI

InChI=1S/C15H22N4O5/c1-9(24-10(2)21)6-4-5-7-19-14(22)12-13(18(3)15(19)23)17-11(8-20)16-12/h9,20H,4-8H2,1-3H3,(H,16,17)