2-[5-[[5-oxidanyl-3,4-bis(phenylmethoxy)-6-[2-[1-(phenylsulfonyl)indol-3-yl]ethoxy]oxan-2-yl]methoxy]pentyl]isoindole-1,3-dione

Systemtic Name: 2-[5-[[5-oxidanyl-3,4-bis(phenylmethoxy)-6-[2-[1-(phenylsulfonyl)indol-3-yl]ethoxy]oxan-2-yl]methoxy]pentyl]isoindole-1,3-dione Openeye Name: 2-[5-[[6-[2-[1-(benzenesulfonyl)indol-3-yl]ethoxy]-3,4-dibenzyloxy-5-hydroxy-tetrahydropyran-2-yl]methoxy]pentyl]isoindoline-1,3-dione CAS Name: 2-[5-[[6-[2-[1-(benzenesulfonyl)-3-indolyl]ethoxy]-5-hydroxy-3,4-bis(phenylmethoxy)-2-oxanyl]methoxy]pentyl]isoindole-1,3-dione IUPAC Name: 2-[5-[[6-[2-[1-(benzenesulfonyl)indol-3-yl]ethoxy]-5-hydroxy-3,4-bis(phenylmethoxy)oxan-2-yl]methoxy]pentyl]isoindole-1,3-dione Traditional Name: 2-[5-[[3,4-dibenzoxy-6-[2-(1-besylindol-3-yl)ethoxy]-5-hydroxy-tetrahydropyran-2-yl]methoxy]pentyl]isoindoline-1,3-quinone Formula: C49H50N2O10S MolecularWeight: 858.9937

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2C(OC(C(C2OCC3=CC=CC=C3)O)OCCC4=CN(C5=CC=CC=C54)S(=O)(=O)C6=CC=CC=C6)COCCCCCN7C(=O)C8=CC=CC=C8C7=O

Isomeric SMILES

C1=CC=C(C=C1)COC2C(OC(C(C2OCC3=CC=CC=C3)O)OCCC4=CN(C5=CC=CC=C54)S(=O)(=O)C6=CC=CC=C6)COCCCCCN7C(=O)C8=CC=CC=C8C7=O

InChI

InChI=1S/C49H50N2O10S/c52-44-46(60-33-36-19-7-2-8-20-36)45(59-32-35-17-5-1-6-18-35)43(34-57-29-16-4-15-28-50-47(53)40-24-11-12-25-41(40)48(50)54)61-49(44)58-30-27-37-31-51(42-26-14-13-23-39(37)42)62(55,56)38-21-9-3-10-22-38/h1-3,5-14,17-26,31,43-46,49,52H,4,15-16,27-30,32-34H2