1-(4-diethoxyphosphorylbutyl)-3-methyl-7-propyl-purine-2,6-dione

Systemtic Name: 1-(4-diethoxyphosphorylbutyl)-3-methyl-7-propyl-purine-2,6-dione Openeye Name: 1-(4-diethoxyphosphorylbutyl)-3-methyl-7-propyl-purine-2,6-dione CAS Name: 1-(4-diethoxyphosphorylbutyl)-3-methyl-7-propylpurine-2,6-dione IUPAC Name: 1-(4-diethoxyphosphorylbutyl)-3-methyl-7-propylpurine-2,6-dione Traditional Name: 1-(4-diethoxyphosphorylbutyl)-3-methyl-7-propyl-xanthine Formula: C17H29N4O5P MolecularWeight: 400.409721

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCP(=O)(OCC)OCC

Isomeric SMILES

CCCN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCP(=O)(OCC)OCC

InChI

InChI=1S/C17H29N4O5P/c1-5-10-20-13-18-15-14(20)16(22)21(17(23)19(15)4)11-8-9-12-27(24,25-6-2)26-7-3/h13H,5-12H2,1-4H3