4,4-bis[2-(dioxidanyl)-2,2-diphenyl-ethyl]-1,2-diphenyl-pyrazolidine-3,5-dione

Systemtic Name: 4,4-bis[2-(dioxidanyl)-2,2-diphenyl-ethyl]-1,2-diphenyl-pyrazolidine-3,5-dione Openeye Name: 4,4-bis(2-hydroperoxy-2,2-diphenyl-ethyl)-1,2-diphenyl-pyrazolidine-3,5-dione CAS Name: 4,4-bis(2-hydroperoxy-2,2-diphenylethyl)-1,2-diphenylpyrazolidine-3,5-dione IUPAC Name: 4,4-bis(2-hydroperoxy-2,2-diphenylethyl)-1,2-diphenylpyrazolidine-3,5-dione Traditional Name: 4,4-bis(2-hydroperoxy-2,2-diphenyl-ethyl)-1,2-diphenyl-pyrazolidine-3,5-quinone Formula: C43H36N2O6 MolecularWeight: 676.75574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC2(C(=O)N(N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)CC(C5=CC=CC=C5)(C6=CC=CC=C6)OO)(C7=CC=CC=C7)OO

Isomeric SMILES

C1=CC=C(C=C1)C(CC2(C(=O)N(N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)CC(C5=CC=CC=C5)(C6=CC=CC=C6)OO)(C7=CC=CC=C7)OO

InChI

InChI=1S/C43H36N2O6/c46-39-41(31-42(50-48,33-19-7-1-8-20-33)34-21-9-2-10-22-34,32-43(51-49,35-23-11-3-12-24-35)36-25-13-4-14-26-36)40(47)45(38-29-17-6-18-30-38)44(39)37-27-15-5-16-28-37/h1-30,48-49H,31-32H2