2-[2-azanyl-6-(dimethylamino)purin-9-yl]ethoxymethyl-phosphonooxy-phosphinic acid

Systemtic Name: 2-[2-azanyl-6-(dimethylamino)purin-9-yl]ethoxymethyl-phosphonooxy-phosphinic acid Openeye Name: 2-[2-amino-6-(dimethylamino)purin-9-yl]ethoxymethyl-phosphonooxy-phosphinic acid CAS Name: 2-[2-amino-6-(dimethylamino)-9-purinyl]ethoxymethyl-phosphonooxyphosphinic acid IUPAC Name: 2-[2-amino-6-(dimethylamino)purin-9-yl]ethoxymethyl-phosphonooxyphosphinic acid Traditional Name: 2-[2-amino-6-(dimethylamino)purin-9-yl]ethoxymethyl-phosphonooxy-phosphinic acid Formula: C10H18N6O7P2 MolecularWeight: 396.233442

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC2=C1N=CN2CCOCP(=O)(O)OP(=O)(O)O)N

Isomeric SMILES

CN(C)C1=NC(=NC2=C1N=CN2CCOCP(=O)(O)OP(=O)(O)O)N

InChI

InChI=1S/C10H18N6O7P2/c1-15(2)8-7-9(14-10(11)13-8)16(5-12-7)3-4-22-6-24(17,18)23-25(19,20)21/h5H,3-4,6H2,1-2H3,(H,17,18)(H2,11,13,14)(H2,19,20,21)