2-[6-[bis(azanyl)methylideneamino]purin-7-yl]ethoxymethylphosphonic acid

Systemtic Name: 2-[6-[bis(azanyl)methylideneamino]purin-7-yl]ethoxymethylphosphonic acid Openeye Name: 2-(6-guanidinopurin-7-yl)ethoxymethylphosphonic acid CAS Name: 2-[6-(diaminomethylideneamino)-7-purinyl]ethoxymethylphosphonic acid IUPAC Name: 2-[6-(diaminomethylideneamino)purin-7-yl]ethoxymethylphosphonic acid Traditional Name: 2-(6-guanidinopurin-7-yl)ethoxymethylphosphonic acid Formula: C9H14N7O4P MolecularWeight: 315.225721

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N=C(N)N)N(C=N2)CCOCP(=O)(O)O

Isomeric SMILES

C1=NC2=C(C(=N1)N=C(N)N)N(C=N2)CCOCP(=O)(O)O

InChI

InChI=1S/C9H14N7O4P/c10-9(11)15-8-6-7(12-3-13-8)14-4-16(6)1-2-20-5-21(17,18)19/h3-4H,1-2,5H2,(H2,17,18,19)(H4,10,11,12,13,15)