1-(2-azanyl-6-azido-purin-9-yl)propan-2-yloxymethylphosphonic acid

Systemtic Name: 1-(2-azanyl-6-azido-purin-9-yl)propan-2-yloxymethylphosphonic acid Openeye Name: [2-(2-amino-6-azido-purin-9-yl)-1-methyl-ethoxy]methylphosphonic acid CAS Name: 1-(2-amino-6-azido-9-purinyl)propan-2-yloxymethylphosphonic acid IUPAC Name: 1-(2-amino-6-azidopurin-9-yl)propan-2-yloxymethylphosphonic acid Traditional Name: [2-(2-amino-6-azido-purin-9-yl)-1-methyl-ethoxy]methylphosphonic acid Formula: C9H13N8O4P MolecularWeight: 328.224481

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=NC2=C(N=C(N=C21)N)N=[N+]=[N-])OCP(=O)(O)O

Isomeric SMILES

CC(CN1C=NC2=C(N=C(N=C21)N)N=[N+]=[N-])OCP(=O)(O)O

InChI

InChI=1S/C9H13N8O4P/c1-5(21-4-22(18,19)20)2-17-3-12-6-7(15-16-11)13-9(10)14-8(6)17/h3,5H,2,4H2,1H3,(H2,10,13,14)(H2,18,19,20)