3-[1-(3-ethoxy-2-oxidanyl-propyl)-5-phenylmethoxy-indol-3-yl]-4-(5-phenylmethoxy-1H-indol-3-yl)pyrrole-2,5-dione

Systemtic Name: 3-[1-(3-ethoxy-2-oxidanyl-propyl)-5-phenylmethoxy-indol-3-yl]-4-(5-phenylmethoxy-1H-indol-3-yl)pyrrole-2,5-dione Openeye Name: 3-[5-benzyloxy-1-(3-ethoxy-2-hydroxy-propyl)indol-3-yl]-4-(5-benzyloxy-1H-indol-3-yl)pyrrole-2,5-dione CAS Name: 3-[1-(3-ethoxy-2-hydroxypropyl)-5-phenylmethoxy-3-indolyl]-4-(5-phenylmethoxy-1H-indol-3-yl)pyrrole-2,5-dione IUPAC Name: 3-[1-(3-ethoxy-2-hydroxypropyl)-5-phenylmethoxyindol-3-yl]-4-(5-phenylmethoxy-1H-indol-3-yl)pyrrole-2,5-dione Traditional Name: 3-[5-benzoxy-1-(3-ethoxy-2-hydroxy-propyl)indol-3-yl]-4-(5-benzoxy-1H-indol-3-yl)-3-pyrroline-2,5-quinone Formula: C39H35N3O6 MolecularWeight: 641.7117

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCC(CN1C=C(C2=C1C=CC(=C2)OCC3=CC=CC=C3)C4=C(C(=O)NC4=O)C5=CNC6=C5C=C(C=C6)OCC7=CC=CC=C7)O

Isomeric SMILES

CCOCC(CN1C=C(C2=C1C=CC(=C2)OCC3=CC=CC=C3)C4=C(C(=O)NC4=O)C5=CNC6=C5C=C(C=C6)OCC7=CC=CC=C7)O

InChI

InChI=1S/C39H35N3O6/c1-2-46-24-27(43)20-42-21-33(31-18-29(14-16-35(31)42)48-23-26-11-7-4-8-12-26)37-36(38(44)41-39(37)45)32-19-40-34-15-13-28(17-30(32)34)47-22-25-9-5-3-6-10-25/h3-19,21,27,40,43H,2,20,22-24H2,1H3,(H,41,44,45)