7-butyl-1-(5-diethoxyphosphorylpentyl)-3-methyl-purine-2,6-dione

Systemtic Name: 7-butyl-1-(5-diethoxyphosphorylpentyl)-3-methyl-purine-2,6-dione Openeye Name: 7-butyl-1-(5-diethoxyphosphorylpentyl)-3-methyl-purine-2,6-dione CAS Name: 7-butyl-1-(5-diethoxyphosphorylpentyl)-3-methylpurine-2,6-dione IUPAC Name: 7-butyl-1-(5-diethoxyphosphorylpentyl)-3-methylpurine-2,6-dione Traditional Name: 7-butyl-1-(5-diethoxyphosphorylpentyl)-3-methyl-xanthine Formula: C19H33N4O5P MolecularWeight: 428.462881

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCP(=O)(OCC)OCC

Isomeric SMILES

CCCCN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCP(=O)(OCC)OCC

InChI

InChI=1S/C19H33N4O5P/c1-5-8-12-22-15-20-17-16(22)18(24)23(19(25)21(17)4)13-10-9-11-14-29(26,27-6-2)28-7-3/h15H,5-14H2,1-4H3