2-(6-aminopurin-9-yl)ethoxymethyl-[2-(diethylamino)-2-oxidanylidene-ethoxy]phosphinic acid

Systemtic Name: 2-(6-aminopurin-9-yl)ethoxymethyl-[2-(diethylamino)-2-oxidanylidene-ethoxy]phosphinic acid Openeye Name: 2-(6-aminopurin-9-yl)ethoxymethyl-[2-(diethylamino)-2-oxo-ethoxy]phosphinic acid CAS Name: 2-(6-aminopurin-9-yl)ethoxymethyl-[2-(diethylamino)-2-oxoethoxy]phosphinic acid IUPAC Name: 2-(6-aminopurin-9-yl)ethoxymethyl-[2-(diethylamino)-2-oxoethoxy]phosphinic acid Traditional Name: 2-adenin-9-ylethoxymethyl-[2-(diethylamino)-2-keto-ethoxy]phosphinic acid Formula: C14H23N6O5P MolecularWeight: 386.343381

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)COP(=O)(COCCN1C=NC2=C1N=CN=C2N)O

Isomeric SMILES

CCN(CC)C(=O)COP(=O)(COCCN1C=NC2=C1N=CN=C2N)O

InChI

InChI=1S/C14H23N6O5P/c1-3-19(4-2)11(21)7-25-26(22,23)10-24-6-5-20-9-18-12-13(15)16-8-17-14(12)20/h8-9H,3-7,10H2,1-2H3,(H,22,23)(H2,15,16,17)