2-(6-carbamimidoylpurin-9-yl)ethoxymethylphosphonic acid

Systemtic Name: 2-(6-carbamimidoylpurin-9-yl)ethoxymethylphosphonic acid Openeye Name: 2-(6-carbamimidoylpurin-9-yl)ethoxymethylphosphonic acid CAS Name: 2-(6-carbamimidoyl-9-purinyl)ethoxymethylphosphonic acid IUPAC Name: 2-(6-carbamimidoylpurin-9-yl)ethoxymethylphosphonic acid Traditional Name: 2-(6-amidinopurin-9-yl)ethoxymethylphosphonic acid Formula: C9H13N6O4P MolecularWeight: 300.211081

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=C2C(=N1)N(C=N2)CCOCP(=O)(O)O)C(=N)N

Isomeric SMILES

C1=NC(=C2C(=N1)N(C=N2)CCOCP(=O)(O)O)C(=N)N

InChI

InChI=1S/C9H13N6O4P/c10-8(11)6-7-9(13-3-12-6)15(4-14-7)1-2-19-5-20(16,17)18/h3-4H,1-2,5H2,(H3,10,11)(H2,16,17,18)