4-[4-tert-butyl-3,5-bis(oxidanylidene)-1,2-diphenyl-pyrazolidin-4-yl]butaneperoxoic acid

Systemtic Name: 4-[4-tert-butyl-3,5-bis(oxidanylidene)-1,2-diphenyl-pyrazolidin-4-yl]butaneperoxoic acid Openeye Name: 4-(4-tert-butyl-3,5-dioxo-1,2-diphenyl-pyrazolidin-4-yl)butaneperoxoic acid CAS Name: 4-(4-tert-butyl-3,5-dioxo-1,2-diphenyl-4-pyrazolidinyl)butaneperoxoic acid IUPAC Name: 4-(4-tert-butyl-3,5-dioxo-1,2-diphenylpyrazolidin-4-yl)butaneperoxoic acid Traditional Name: 4-(4-tert-butyl-3,5-diketo-1,2-diphenyl-pyrazolidin-4-yl)peroxybutyric acid Formula: C23H26N2O5 MolecularWeight: 410.46294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)CCCC(=O)OO

Isomeric SMILES

CC(C)(C)C1(C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)CCCC(=O)OO

InChI

InChI=1S/C23H26N2O5/c1-22(2,3)23(16-10-15-19(26)30-29)20(27)24(17-11-6-4-7-12-17)25(21(23)28)18-13-8-5-9-14-18/h4-9,11-14,29H,10,15-16H2,1-3H3