2-[6-(aminomethyl)-2-azanyl-purin-9-yl]ethoxymethylphosphonic acid

Systemtic Name: 2-[6-(aminomethyl)-2-azanyl-purin-9-yl]ethoxymethylphosphonic acid Openeye Name: 2-[2-amino-6-(aminomethyl)purin-9-yl]ethoxymethylphosphonic acid CAS Name: 2-[2-amino-6-(aminomethyl)-9-purinyl]ethoxymethylphosphonic acid IUPAC Name: 2-[2-amino-6-(aminomethyl)purin-9-yl]ethoxymethylphosphonic acid Traditional Name: 2-[2-amino-6-(aminomethyl)purin-9-yl]ethoxymethylphosphonic acid Formula: C9H15N6O4P MolecularWeight: 302.226961

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N=C(N=C2N1CCOCP(=O)(O)O)N)CN

Isomeric SMILES

C1=NC2=C(N=C(N=C2N1CCOCP(=O)(O)O)N)CN

InChI

InChI=1S/C9H15N6O4P/c10-3-6-7-8(14-9(11)13-6)15(4-12-7)1-2-19-5-20(16,17)18/h4H,1-3,5,10H2,(H2,11,13,14)(H2,16,17,18)