N-[9-[5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-3-oxidanyl-4-prop-2-enoxy-oxolan-2-yl]purin-6-yl]benzamide

Systemtic Name: N-[9-[5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-3-oxidanyl-4-prop-2-enoxy-oxolan-2-yl]purin-6-yl]benzamide Openeye Name: N-[9-[4-allyloxy-5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-3-hydroxy-tetrahydrofuran-2-yl]purin-6-yl]benzamide CAS Name: N-[9-[5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-3-hydroxy-4-prop-2-enoxy-2-oxolanyl]-6-purinyl]benzamide IUPAC Name: N-[9-[5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-3-hydroxy-4-prop-2-enoxyoxolan-2-yl]purin-6-yl]benzamide Traditional Name: N-[9-[4-allyloxy-5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-3-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(C(C(O4)N5C=NC6=C5N=CN=C6NC(=O)C7=CC=CC=C7)O)OCC=C

Isomeric SMILES

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

InChI

InChI=1S/C41H39N5O7/c1-4-23-51-36-33(53-40(35(36)47)46-26-44-34-37(42-25-43-38(34)46)45-39(48)27-11-7-5-8-12-27)24-52-41(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/h4-22,25-26,33,35-36,40,47H,1,23-24H2,2-3H3,(H,42,43,45,48)