2-(1H-indol-3-yl)-1-[4-(2-methoxyphenyl)-4,5-bis(oxidanyl)-7,7-diphenyl-1,3,3a,5,6,7a-hexahydroisoindol-2-yl]ethanone

Systemtic Name: 2-(1H-indol-3-yl)-1-[4-(2-methoxyphenyl)-4,5-bis(oxidanyl)-7,7-diphenyl-1,3,3a,5,6,7a-hexahydroisoindol-2-yl]ethanone Openeye Name: 1-[4,5-dihydroxy-4-(2-methoxyphenyl)-7,7-diphenyl-1,3,3a,5,6,7a-hexahydroisoindol-2-yl]-2-(1H-indol-3-yl)ethanone CAS Name: 1-[4,5-dihydroxy-4-(2-methoxyphenyl)-7,7-diphenyl-1,3,3a,5,6,7a-hexahydroisoindol-2-yl]-2-(1H-indol-3-yl)ethanone IUPAC Name: 1-[4,5-dihydroxy-4-(2-methoxyphenyl)-7,7-diphenyl-1,3,3a,5,6,7a-hexahydroisoindol-2-yl]-2-(1H-indol-3-yl)ethanone Traditional Name: 1-[4,5-dihydroxy-4-(2-methoxyphenyl)-7,7-diphenyl-1,3,3a,5,6,7a-hexahydroisoindol-2-yl]-2-(1H-indol-3-yl)ethanone Formula: C37H36N2O4 MolecularWeight: 572.69274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2(C(CC(C3C2CN(C3)C(=O)CC4=CNC5=CC=CC=C54)(C6=CC=CC=C6)C7=CC=CC=C7)O)O

Isomeric SMILES

COC1=CC=CC=C1C2(C(CC(C3C2CN(C3)C(=O)CC4=CNC5=CC=CC=C54)(C6=CC=CC=C6)C7=CC=CC=C7)O)O

InChI

InChI=1S/C37H36N2O4/c1-43-33-19-11-9-17-29(33)37(42)31-24-39(35(41)20-25-22-38-32-18-10-8-16-28(25)32)23-30(31)36(21-34(37)40,26-12-4-2-5-13-26)27-14-6-3-7-15-27/h2-19,22,30-31,34,38,40,42H,20-21,23-24H2,1H3