1-(6-chloranyl-7H-purin-8-yl)propan-2-yloxymethylphosphonic acid

Systemtic Name: 1-(6-chloranyl-7H-purin-8-yl)propan-2-yloxymethylphosphonic acid Openeye Name: [2-(6-chloro-7H-purin-8-yl)-1-methyl-ethoxy]methylphosphonic acid CAS Name: 1-(6-chloro-7H-purin-8-yl)propan-2-yloxymethylphosphonic acid IUPAC Name: 1-(6-chloro-7H-purin-8-yl)propan-2-yloxymethylphosphonic acid Traditional Name: [2-(6-chloro-7H-purin-8-yl)-1-methyl-ethoxy]methylphosphonic acid Formula: C9H12ClN4O4P MolecularWeight: 306.642741

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=NC2=C(N1)C(=NC=N2)Cl)OCP(=O)(O)O

Isomeric SMILES

CC(CC1=NC2=C(N1)C(=NC=N2)Cl)OCP(=O)(O)O

InChI

InChI=1S/C9H12ClN4O4P/c1-5(18-4-19(15,16)17)2-6-13-7-8(10)11-3-12-9(7)14-6/h3,5H,2,4H2,1H3,(H2,15,16,17)(H,11,12,13,14)