2-azanyl-9-[4-diethoxyphosphoryl-2-(hydroxymethyl)butoxy]-7,8-dihydro-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[4-diethoxyphosphoryl-2-(hydroxymethyl)butoxy]-7,8-dihydro-3H-purin-6-one Openeye Name: 2-amino-9-[4-diethoxyphosphoryl-2-(hydroxymethyl)butoxy]-7,8-dihydro-3H-purin-6-one CAS Name: 2-amino-9-[4-diethoxyphosphoryl-2-(hydroxymethyl)butoxy]-7,8-dihydro-3H-purin-6-one IUPAC Name: 2-amino-9-[4-diethoxyphosphoryl-2-(hydroxymethyl)butoxy]-7,8-dihydro-3H-purin-6-one Traditional Name: 2-amino-9-(4-diethoxyphosphoryl-2-methylol-butoxy)-7,8-dihydro-3H-purin-6-one Formula: C14H26N5O6P MolecularWeight: 391.359901

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CCC(CO)CON1CNC2=C1NC(=NC2=O)N)OCC

Isomeric SMILES

CCOP(=O)(CCC(CO)CON1CNC2=C1NC(=NC2=O)N)OCC

InChI

InChI=1S/C14H26N5O6P/c1-3-24-26(22,25-4-2)6-5-10(7-20)8-23-19-9-16-11-12(19)17-14(15)18-13(11)21/h10,16,20H,3-9H2,1-2H3,(H3,15,17,18,21)