[4-(2-azanylpurin-9-yl)-2-(hydroxymethyl)butyl] ethyl carbonate

Systemtic Name: [4-(2-azanylpurin-9-yl)-2-(hydroxymethyl)butyl] ethyl carbonate Openeye Name: [4-(2-aminopurin-9-yl)-2-(hydroxymethyl)butyl] ethyl carbonate CAS Name: carbonic acid [4-(2-amino-9-purinyl)-2-(hydroxymethyl)butyl] ethyl ester IUPAC Name: [4-(2-aminopurin-9-yl)-2-(hydroxymethyl)butyl] ethyl carbonate Traditional Name: carbonic acid [4-(2-aminopurin-9-yl)-2-methylol-butyl] ethyl ester Formula: C13H19N5O4 MolecularWeight: 309.32106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OCC(CCN1C=NC2=CN=C(N=C21)N)CO

Isomeric SMILES

CCOC(=O)OCC(CCN1C=NC2=CN=C(N=C21)N)CO

InChI

InChI=1S/C13H19N5O4/c1-2-21-13(20)22-7-9(6-19)3-4-18-8-16-10-5-15-12(14)17-11(10)18/h5,8-9,19H,2-4,6-7H2,1H3,(H2,14,15,17)