2-(6-aminopurin-9-yl)ethoxymethyl-octoxy-phosphinic acid

Systemtic Name: 2-(6-aminopurin-9-yl)ethoxymethyl-octoxy-phosphinic acid Openeye Name: 2-(6-aminopurin-9-yl)ethoxymethyl-octoxy-phosphinic acid CAS Name: 2-(6-aminopurin-9-yl)ethoxymethyl-octoxyphosphinic acid IUPAC Name: 2-(6-aminopurin-9-yl)ethoxymethyl-octoxyphosphinic acid Traditional Name: 2-adenin-9-ylethoxymethyl(octoxy)phosphinic acid Formula: C16H28N5O4P MolecularWeight: 385.398381

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOP(=O)(COCCN1C=NC2=C1N=CN=C2N)O

Isomeric SMILES

CCCCCCCCOP(=O)(COCCN1C=NC2=C1N=CN=C2N)O

InChI

InChI=1S/C16H28N5O4P/c1-2-3-4-5-6-7-9-25-26(22,23)13-24-10-8-21-12-20-14-15(17)18-11-19-16(14)21/h11-12H,2-10,13H2,1H3,(H,22,23)(H2,17,18,19)