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

Systemtic Name: 3-[(6-azanyl-8-ethyl-7H-purin-2-yl)oxy]pentan-3-ylphosphonic acid Openeye Name: [1-[(6-amino-8-ethyl-7H-purin-2-yl)oxy]-1-ethyl-propyl]phosphonic acid CAS Name: 3-[(6-amino-8-ethyl-7H-purin-2-yl)oxy]pentan-3-ylphosphonic acid IUPAC Name: 3-[(6-amino-8-ethyl-7H-purin-2-yl)oxy]pentan-3-ylphosphonic acid Traditional Name: [1-[(6-amino-8-ethyl-7H-purin-2-yl)oxy]-1-ethyl-propyl]phosphonic acid Formula: C12H20N5O4P MolecularWeight: 329.292061

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1)C(=NC(=N2)OC(CC)(CC)P(=O)(O)O)N

Isomeric SMILES

CCC1=NC2=C(N1)C(=NC(=N2)OC(CC)(CC)P(=O)(O)O)N

InChI

InChI=1S/C12H20N5O4P/c1-4-7-14-8-9(13)16-11(17-10(8)15-7)21-12(5-2,6-3)22(18,19)20/h4-6H2,1-3H3,(H2,18,19,20)(H3,13,14,15,16,17)