[(1R,2R)-2-(6-oxidanylidene-3H-purin-9-yl)cycloheptyl]oxymethylphosphonic acid

Systemtic Name: [(1R,2R)-2-(6-oxidanylidene-3H-purin-9-yl)cycloheptyl]oxymethylphosphonic acid Openeye Name: [(1R,2R)-2-(6-oxo-3H-purin-9-yl)cycloheptoxy]methylphosphonic acid CAS Name: [(1R,2R)-2-(6-oxo-3H-purin-9-yl)cycloheptyl]oxymethylphosphonic acid IUPAC Name: [(1R,2R)-2-(6-oxo-3H-purin-9-yl)cycloheptyl]oxymethylphosphonic acid Traditional Name: [(1R,2R)-2-(6-keto-3H-purin-9-yl)cycloheptoxy]methylphosphonic acid Formula: C13H19N4O5P MolecularWeight: 342.287521

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(CC1)OCP(=O)(O)O)N2C=NC3=C2NC=NC3=O

Isomeric SMILES

C1CC[C@H]([C@@H](CC1)OCP(=O)(O)O)N2C=NC3=C2NC=NC3=O

InChI

InChI=1S/C13H19N4O5P/c18-13-11-12(14-6-15-13)17(7-16-11)9-4-2-1-3-5-10(9)22-8-23(19,20)21/h6-7,9-10H,1-5,8H2,(H,14,15,18)(H2,19,20,21)/t9-,10-/m1/s1