9-[(E)-4-diethoxyphosphorylbut-3-enoxy]purin-6-amine

Systemtic Name: 9-[(E)-4-diethoxyphosphorylbut-3-enoxy]purin-6-amine Openeye Name: 9-[(E)-4-diethoxyphosphorylbut-3-enoxy]purin-6-amine CAS Name: 9-[(E)-4-diethoxyphosphorylbut-3-enoxy]-6-purinamine IUPAC Name: 9-[(E)-4-diethoxyphosphorylbut-3-enoxy]purin-6-amine Traditional Name: [9-[(E)-4-diethoxyphosphorylbut-3-enoxy]purin-6-yl]amine Formula: C13H20N5O4P MolecularWeight: 341.302761

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C=CCCON1C=NC2=C1N=CN=C2N)OCC

Isomeric SMILES

CCOP(=O)(/C=C/CCON1C=NC2=C1N=CN=C2N)OCC

InChI

InChI=1S/C13H20N5O4P/c1-3-21-23(19,22-4-2)8-6-5-7-20-18-10-17-11-12(14)15-9-16-13(11)18/h6,8-10H,3-5,7H2,1-2H3,(H2,14,15,16)/b8-6+