3-[1-(6-azanyl-7H-purin-2-yl)propoxy]pentan-3-ylphosphonic acid

Systemtic Name: 3-[1-(6-azanyl-7H-purin-2-yl)propoxy]pentan-3-ylphosphonic acid Openeye Name: [1-[1-(6-amino-7H-purin-2-yl)propoxy]-1-ethyl-propyl]phosphonic acid CAS Name: 3-[1-(6-amino-7H-purin-2-yl)propoxy]pentan-3-ylphosphonic acid IUPAC Name: 3-[1-(6-amino-7H-purin-2-yl)propoxy]pentan-3-ylphosphonic acid Traditional Name: [1-[1-(6-amino-7H-purin-2-yl)propoxy]-1-ethyl-propyl]phosphonic acid Formula: C13H22N5O4P MolecularWeight: 343.318641

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=C(C(=N1)N)NC=N2)OC(CC)(CC)P(=O)(O)O

Isomeric SMILES

CCC(C1=NC2=C(C(=N1)N)NC=N2)OC(CC)(CC)P(=O)(O)O

InChI

InChI=1S/C13H22N5O4P/c1-4-8(22-13(5-2,6-3)23(19,20)21)11-17-10(14)9-12(18-11)16-7-15-9/h7-8H,4-6H2,1-3H3,(H2,19,20,21)(H3,14,15,16,17,18)