AC1O0XNS

6-[(3E)-3-[(4-bromophenyl)-hydroxymethylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]hexanoic acid

Also Known As: BAS 01029116|6-(3-(4-bromobenzoyl)-4-hydroxy-2-(4-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)hexanoic acid|6-[(3E)-3-[(4-bromophenyl)(hydroxy)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]hexanoic acid|6-[(3E)-3-[(4-bromophenyl)-hydroxymethylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]hexanoic acid

Molecular Formula	C23H21BrN2O7
Molecular Weight	516.0532 g/mol
LogP	4.424
Topological Polar Surface Area	138.05 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	9
Exact Mass	516.0532
Monoisotopic Mass	516.0532
Heavy Atoms	33
Complexity	1110.6348

Chemical Identifiers

CAS Number	333776-72-0
SMILES	C1=CC(=CC=C1C2/C(=C(/C3=CC=C(C=C3)Br)\O)/C(=O)C(=O)N2CCCCCC(=O)O)[N+](=O)[O-]