(E)-5-(6-aminopurin-9-yl)-1-diethoxyphosphoryl-pent-1-en-3-ol

Systemtic Name: (E)-5-(6-aminopurin-9-yl)-1-diethoxyphosphoryl-pent-1-en-3-ol Openeye Name: (E)-5-(6-aminopurin-9-yl)-1-diethoxyphosphoryl-pent-1-en-3-ol CAS Name: (E)-5-(6-aminopurin-9-yl)-1-diethoxyphosphoryl-1-penten-3-ol IUPAC Name: (E)-5-(6-aminopurin-9-yl)-1-diethoxyphosphorylpent-1-en-3-ol Traditional Name: (E)-5-adenin-9-yl-1-diethoxyphosphoryl-pent-1-en-3-ol Formula: C14H22N5O4P MolecularWeight: 355.329341

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C=CC(CCN1C=NC2=C1N=CN=C2N)O)OCC

Isomeric SMILES

CCOP(=O)(/C=C/C(CCN1C=NC2=C1N=CN=C2N)O)OCC

InChI

InChI=1S/C14H22N5O4P/c1-3-22-24(21,23-4-2)8-6-11(20)5-7-19-10-18-12-13(15)16-9-17-14(12)19/h6,8-11,20H,3-5,7H2,1-2H3,(H2,15,16,17)/b8-6+