2-(6-aminopurin-9-yl)ethoxymethyl-[1,3-bis(oxidanyl)propan-2-yloxy]phosphinic acid

Systemtic Name: 2-(6-aminopurin-9-yl)ethoxymethyl-[1,3-bis(oxidanyl)propan-2-yloxy]phosphinic acid Openeye Name: 2-(6-aminopurin-9-yl)ethoxymethyl-[2-hydroxy-1-(hydroxymethyl)ethoxy]phosphinic acid CAS Name: 2-(6-aminopurin-9-yl)ethoxymethyl-(1,3-dihydroxypropan-2-yloxy)phosphinic acid IUPAC Name: 2-(6-aminopurin-9-yl)ethoxymethyl-(1,3-dihydroxypropan-2-yloxy)phosphinic acid Traditional Name: 2-adenin-9-ylethoxymethyl-(2-hydroxy-1-methylol-ethoxy)phosphinic acid Formula: C11H18N5O6P MolecularWeight: 347.264281

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2CCOCP(=O)(O)OC(CO)CO

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2CCOCP(=O)(O)OC(CO)CO

InChI

InChI=1S/C11H18N5O6P/c12-10-9-11(14-5-13-10)16(6-15-9)1-2-21-7-23(19,20)22-8(3-17)4-18/h5-6,8,17-18H,1-4,7H2,(H,19,20)(H2,12,13,14)