[2-(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)-4-(hydroxymethyl)-2-methyl-cyclobutyl] ethanoate

Systemtic Name: [2-(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)-4-(hydroxymethyl)-2-methyl-cyclobutyl] ethanoate Openeye Name: [2-(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)-4-(hydroxymethyl)-2-methyl-cyclobutyl] acetate CAS Name: acetic acid [2-(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)-4-(hydroxymethyl)-2-methylcyclobutyl] ester IUPAC Name: [2-(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)-4-(hydroxymethyl)-2-methylcyclobutyl] acetate Traditional Name: acetic acid [2-(2-amino-6-keto-7,8-dihydro-3H-purin-9-yl)-2-methyl-4-methylol-cyclobutyl] ester Formula: C13H19N5O4 MolecularWeight: 309.32106

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(CC1(C)N2CNC3=C2NC(=NC3=O)N)CO

Isomeric SMILES

CC(=O)OC1C(CC1(C)N2CNC3=C2NC(=NC3=O)N)CO

InChI

InChI=1S/C13H19N5O4/c1-6(20)22-9-7(4-19)3-13(9,2)18-5-15-8-10(18)16-12(14)17-11(8)21/h7,9,15,19H,3-5H2,1-2H3,(H3,14,16,17,21)