6-chloranyl-9-[(4-diethoxyphosphoryl-1-methoxy-butan-2-yl)oxymethyl]purin-2-amine

Systemtic Name: 6-chloranyl-9-[(4-diethoxyphosphoryl-1-methoxy-butan-2-yl)oxymethyl]purin-2-amine Openeye Name: 6-chloro-9-[[3-diethoxyphosphoryl-1-(methoxymethyl)propoxy]methyl]purin-2-amine CAS Name: 6-chloro-9-[(4-diethoxyphosphoryl-1-methoxybutan-2-yl)oxymethyl]-2-purinamine IUPAC Name: 6-chloro-9-[(4-diethoxyphosphoryl-1-methoxybutan-2-yl)oxymethyl]purin-2-amine Traditional Name: [6-chloro-9-[[3-diethoxyphosphoryl-1-(methoxymethyl)propoxy]methyl]purin-2-yl]amine Formula: C15H25ClN5O5P MolecularWeight: 421.816261

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CCC(COC)OCN1C=NC2=C1N=C(N=C2Cl)N)OCC

Isomeric SMILES

CCOP(=O)(CCC(COC)OCN1C=NC2=C1N=C(N=C2Cl)N)OCC

InChI

InChI=1S/C15H25ClN5O5P/c1-4-25-27(22,26-5-2)7-6-11(8-23-3)24-10-21-9-18-12-13(16)19-15(17)20-14(12)21/h9,11H,4-8,10H2,1-3H3,(H2,17,19,20)