4-butyl-1,2-diphenyl-pyrazolidine-3,5-dione; (2-methylpropan-2-yl)oxy benzenecarboperoxoate

Systemtic Name: 4-butyl-1,2-diphenyl-pyrazolidine-3,5-dione; (2-methylpropan-2-yl)oxy benzenecarboperoxoate Openeye Name: tert-butoxy benzenecarboperoxoate; 4-butyl-1,2-diphenyl-pyrazolidine-3,5-dione CAS Name: benzenecarboperoxoic acid (2-methylpropan-2-yl)oxy ester; 4-butyl-1,2-diphenylpyrazolidine-3,5-dione IUPAC Name: 4-butyl-1,2-diphenylpyrazolidine-3,5-dione; (2-methylpropan-2-yl)oxy benzenecarboperoxoate Traditional Name: benzenecarboperoxoic acid tert-butoxy ester; 4-butyl-1,2-diphenyl-pyrazolidine-3,5-quinone Formula: C30H34N2O6 MolecularWeight: 518.60076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3.CC(C)(C)OOOC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCC1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3.CC(C)(C)OOOC(=O)C1=CC=CC=C1

InChI

InChI=1S/C19H20N2O2.C11H14O4/c1-2-3-14-17-18(22)20(15-10-6-4-7-11-15)21(19(17)23)16-12-8-5-9-13-16;1-11(2,3)14-15-13-10(12)9-7-5-4-6-8-9/h4-13,17H,2-3,14H2,1H3;4-8H,1-3H3