methyl 3-(6-aminopurin-9-yl)-2-dimethoxyphosphoryl-propanoate

Systemtic Name: methyl 3-(6-aminopurin-9-yl)-2-dimethoxyphosphoryl-propanoate Openeye Name: methyl 3-(6-aminopurin-9-yl)-2-dimethoxyphosphoryl-propanoate CAS Name: 3-(6-aminopurin-9-yl)-2-dimethoxyphosphorylpropanoic acid methyl ester IUPAC Name: methyl 3-(6-aminopurin-9-yl)-2-dimethoxyphosphorylpropanoate Traditional Name: 3-adenin-9-yl-2-dimethoxyphosphoryl-propionic acid methyl ester Formula: C11H16N5O5P MolecularWeight: 329.249001

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CN1C=NC2=C1N=CN=C2N)P(=O)(OC)OC

Isomeric SMILES

COC(=O)C(CN1C=NC2=C1N=CN=C2N)P(=O)(OC)OC

InChI

InChI=1S/C11H16N5O5P/c1-19-11(17)7(22(18,20-2)21-3)4-16-6-15-8-9(12)13-5-14-10(8)16/h5-7H,4H2,1-3H3,(H2,12,13,14)