3-[(6-azanyl-8-propyl-7H-purin-2-yl)oxy]pentan-3-ylphosphonic acid

Systemtic Name: 3-[(6-azanyl-8-propyl-7H-purin-2-yl)oxy]pentan-3-ylphosphonic acid Openeye Name: [1-[(6-amino-8-propyl-7H-purin-2-yl)oxy]-1-ethyl-propyl]phosphonic acid CAS Name: 3-[(6-amino-8-propyl-7H-purin-2-yl)oxy]pentan-3-ylphosphonic acid IUPAC Name: 3-[(6-amino-8-propyl-7H-purin-2-yl)oxy]pentan-3-ylphosphonic acid Traditional Name: [1-[(6-amino-8-propyl-7H-purin-2-yl)oxy]-1-ethyl-propyl]phosphonic acid Formula: C13H22N5O4P MolecularWeight: 343.318641

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(N1)C(=NC(=N2)OC(CC)(CC)P(=O)(O)O)N

Isomeric SMILES

CCCC1=NC2=C(N1)C(=NC(=N2)OC(CC)(CC)P(=O)(O)O)N

InChI

InChI=1S/C13H22N5O4P/c1-4-7-8-15-9-10(14)17-12(18-11(9)16-8)22-13(5-2,6-3)23(19,20)21/h4-7H2,1-3H3,(H2,19,20,21)(H3,14,15,16,17,18)