1-[2-[6-(6-aminopurin-9-yl)hexoxy]-5-(diethoxyphosphorylmethyl)phenyl]ethanone

Systemtic Name: 1-[2-[6-(6-aminopurin-9-yl)hexoxy]-5-(diethoxyphosphorylmethyl)phenyl]ethanone Openeye Name: 1-[2-[6-(6-aminopurin-9-yl)hexoxy]-5-(diethoxyphosphorylmethyl)phenyl]ethanone CAS Name: 1-[2-[6-(6-aminopurin-9-yl)hexoxy]-5-(diethoxyphosphorylmethyl)phenyl]ethanone IUPAC Name: 1-[2-[6-(6-aminopurin-9-yl)hexoxy]-5-(diethoxyphosphorylmethyl)phenyl]ethanone Traditional Name: 1-[2-(6-adenin-9-ylhexoxy)-5-(diethoxyphosphorylmethyl)phenyl]ethanone Formula: C24H34N5O5P MolecularWeight: 503.531021

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC1=CC(=C(C=C1)OCCCCCCN2C=NC3=C2N=CN=C3N)C(=O)C)OCC

Isomeric SMILES

CCOP(=O)(CC1=CC(=C(C=C1)OCCCCCCN2C=NC3=C2N=CN=C3N)C(=O)C)OCC

InChI

InChI=1S/C24H34N5O5P/c1-4-33-35(31,34-5-2)15-19-10-11-21(20(14-19)18(3)30)32-13-9-7-6-8-12-29-17-28-22-23(25)26-16-27-24(22)29/h10-11,14,16-17H,4-9,12-13,15H2,1-3H3,(H2,25,26,27)