azanium 2-[2,6-bis(azanyl)purin-9-yl]ethoxymethyl-ethoxy-phosphinate

Systemtic Name: azanium 2-[2,6-bis(azanyl)purin-9-yl]ethoxymethyl-ethoxy-phosphinate Openeye Name: ammonium 2-(2,6-diaminopurin-9-yl)ethoxymethyl-ethoxy-phosphinate CAS Name: ammonium 2-(2,6-diamino-9-purinyl)ethoxymethyl-ethoxyphosphinate IUPAC Name: azanium 2-(2,6-diaminopurin-9-yl)ethoxymethyl-ethoxyphosphinate Traditional Name: ammonium 2-(2,6-diaminopurin-9-yl)ethoxymethyl-ethoxy-phosphinate Formula: C10H20N7O4P MolecularWeight: 333.284061

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(COCCN1C=NC2=C1N=C(N=C2N)N)[O-].[NH4+]

Isomeric SMILES

CCOP(=O)(COCCN1C=NC2=C1N=C(N=C2N)N)[O-].[NH4+]

InChI

InChI=1S/C10H17N6O4P.H3N/c1-2-20-21(17,18)6-19-4-3-16-5-13-7-8(11)14-10(12)15-9(7)16;/h5H,2-4,6H2,1H3,(H,17,18)(H4,11,12,14,15);1H3