N-[9-[2-(dimorpholin-4-ylphosphorylmethoxy)ethyl]purin-6-yl]benzamide

Systemtic Name: N-[9-[2-(dimorpholin-4-ylphosphorylmethoxy)ethyl]purin-6-yl]benzamide Openeye Name: N-[9-[2-(dimorpholinophosphorylmethoxy)ethyl]purin-6-yl]benzamide CAS Name: N-[9-[2-[bis(4-morpholinyl)phosphorylmethoxy]ethyl]-6-purinyl]benzamide IUPAC Name: N-[9-[2-(dimorpholin-4-ylphosphorylmethoxy)ethyl]purin-6-yl]benzamide Traditional Name: N-[9-[2-(dimorpholinophosphorylmethoxy)ethyl]purin-6-yl]benzamide Formula: C23H30N7O5P MolecularWeight: 515.501961

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1P(=O)(COCCN2C=NC3=C2N=CN=C3NC(=O)C4=CC=CC=C4)N5CCOCC5

Isomeric SMILES

C1COCCN1P(=O)(COCCN2C=NC3=C2N=CN=C3NC(=O)C4=CC=CC=C4)N5CCOCC5

InChI

InChI=1S/C23H30N7O5P/c31-23(19-4-2-1-3-5-19)27-21-20-22(25-16-24-21)28(17-26-20)6-11-35-18-36(32,29-7-12-33-13-8-29)30-9-14-34-15-10-30/h1-5,16-17H,6-15,18H2,(H,24,25,27,31)