[(Z)-4-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)but-2-enoxy]methyl-ethoxy-phosphinic acid

Systemtic Name: [(Z)-4-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)but-2-enoxy]methyl-ethoxy-phosphinic acid Openeye Name: [(Z)-4-(2-amino-6-oxo-3H-purin-9-yl)but-2-enoxy]methyl-ethoxy-phosphinic acid CAS Name: [(Z)-4-(2-amino-6-oxo-3H-purin-9-yl)but-2-enoxy]methyl-ethoxyphosphinic acid IUPAC Name: [(Z)-4-(2-amino-6-oxo-3H-purin-9-yl)but-2-enoxy]methyl-ethoxyphosphinic acid Traditional Name: [(Z)-4-(2-amino-6-keto-3H-purin-9-yl)but-2-enoxy]methyl-ethoxy-phosphinic acid Formula: C12H18N5O5P MolecularWeight: 343.275581

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(COCC=CCN1C=NC2=C1NC(=NC2=O)N)O

Isomeric SMILES

CCOP(=O)(COC/C=C\CN1C=NC2=C1NC(=NC2=O)N)O

InChI

InChI=1S/C12H18N5O5P/c1-2-22-23(19,20)8-21-6-4-3-5-17-7-14-9-10(17)15-12(13)16-11(9)18/h3-4,7H,2,5-6,8H2,1H3,(H,19,20)(H3,13,15,16,18)/b4-3-