7-(3-diethoxyphosphorylpropyl)-1,3-dipropyl-purine-2,6-dione

Systemtic Name: 7-(3-diethoxyphosphorylpropyl)-1,3-dipropyl-purine-2,6-dione Openeye Name: 7-(3-diethoxyphosphorylpropyl)-1,3-dipropyl-purine-2,6-dione CAS Name: 7-(3-diethoxyphosphorylpropyl)-1,3-dipropylpurine-2,6-dione IUPAC Name: 7-(3-diethoxyphosphorylpropyl)-1,3-dipropylpurine-2,6-dione Traditional Name: 7-(3-diethoxyphosphorylpropyl)-1,3-dipropyl-xanthine Formula: C18H31N4O5P MolecularWeight: 414.436301

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)N(C=N2)CCCP(=O)(OCC)OCC

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)N(C=N2)CCCP(=O)(OCC)OCC

InChI

InChI=1S/C18H31N4O5P/c1-5-10-21-16-15(17(23)22(11-6-2)18(21)24)20(14-19-16)12-9-13-28(25,26-7-3)27-8-4/h14H,5-13H2,1-4H3