[3-(2-azanylpurin-9-yl)-2-(hydroxymethyl)cyclobutyl]methyl ethyl hydrogen phosphate

Systemtic Name: [3-(2-azanylpurin-9-yl)-2-(hydroxymethyl)cyclobutyl]methyl ethyl hydrogen phosphate Openeye Name: [3-(2-aminopurin-9-yl)-2-(hydroxymethyl)cyclobutyl]methyl ethyl hydrogen phosphate CAS Name: [3-(2-amino-9-purinyl)-2-(hydroxymethyl)cyclobutyl]methyl ethyl hydrogen phosphate IUPAC Name: [3-(2-aminopurin-9-yl)-2-(hydroxymethyl)cyclobutyl]methyl ethyl hydrogen phosphate Traditional Name: [3-(2-aminopurin-9-yl)-2-methylol-cyclobutyl]methyl ethyl hydrogen phosphate Formula: C13H20N5O5P MolecularWeight: 357.302161

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(O)OCC1CC(C1CO)N2C=NC3=CN=C(N=C32)N

Isomeric SMILES

CCOP(=O)(O)OCC1CC(C1CO)N2C=NC3=CN=C(N=C32)N

InChI

InChI=1S/C13H20N5O5P/c1-2-22-24(20,21)23-6-8-3-11(9(8)5-19)18-7-16-10-4-15-13(14)17-12(10)18/h4,7-9,11,19H,2-3,5-6H2,1H3,(H,20,21)(H2,14,15,17)