N-[9-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-oxidanyl-oxolan-2-yl]-2-prop-2-enoxy-purin-6-yl]benzamide

Systemtic Name: N-[9-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-oxidanyl-oxolan-2-yl]-2-prop-2-enoxy-purin-6-yl]benzamide Openeye Name: N-[2-allyloxy-9-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-hydroxy-tetrahydrofuran-2-yl]purin-6-yl]benzamide CAS Name: N-[9-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxy-2-oxolanyl]-2-prop-2-enoxy-6-purinyl]benzamide IUPAC Name: N-[9-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxyoxolan-2-yl]-2-prop-2-enoxypurin-6-yl]benzamide Traditional Name: N-[2-allyloxy-9-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-hydroxy-tetrahydrofuran-2-yl]purin-6-yl]benzamide Formula: C41H39N5O7 MolecularWeight: 713.77766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OCC4C(CC(O4)N5C=NC6=C5N=C(N=C6NC(=O)C7=CC=CC=C7)OCC=C)O

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OC[C@@H]4[C@H](C[C@@H](O4)N5C=NC6=C5N=C(N=C6NC(=O)C7=CC=CC=C7)OCC=C)O

InChI

InChI=1S/C41H39N5O7/c1-4-23-51-40-44-37(43-39(48)27-11-7-5-8-12-27)36-38(45-40)46(26-42-36)35-24-33(47)34(53-35)25-52-41(28-13-9-6-10-14-28,29-15-19-31(49-2)20-16-29)30-17-21-32(50-3)22-18-30/h4-22,26,33-35,47H,1,23-25H2,2-3H3,(H,43,44,45,48)/t33-,34+,35+/m0/s1