[4-(2-azanylpurin-9-yl)-2-(propanoyloxymethyl)butyl] propanoate

Systemtic Name: [4-(2-azanylpurin-9-yl)-2-(propanoyloxymethyl)butyl] propanoate Openeye Name: [4-(2-aminopurin-9-yl)-2-(propanoyloxymethyl)butyl] propanoate CAS Name: propanoic acid [4-(2-amino-9-purinyl)-2-(1-oxopropoxymethyl)butyl] ester IUPAC Name: [4-(2-aminopurin-9-yl)-2-(propanoyloxymethyl)butyl] propanoate Traditional Name: propionic acid [4-(2-aminopurin-9-yl)-2-(propionyloxymethyl)butyl] ester Formula: C16H23N5O4 MolecularWeight: 349.38492

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OCC(CCN1C=NC2=CN=C(N=C21)N)COC(=O)CC

Isomeric SMILES

CCC(=O)OCC(CCN1C=NC2=CN=C(N=C21)N)COC(=O)CC

InChI

InChI=1S/C16H23N5O4/c1-3-13(22)24-8-11(9-25-14(23)4-2)5-6-21-10-19-12-7-18-16(17)20-15(12)21/h7,10-11H,3-6,8-9H2,1-2H3,(H2,17,18,20)