AC1NRIEX

3-[(3E)-3-[(4-chlorophenyl)-hydroxymethylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]propanoic acid

Also Known As: Oprea1_159593|Oprea1_464808|BAS 02378673|AG-690/40639718|A2624/0111664|3-(3-(4-chlorobenzoyl)-4-hydroxy-2-{4-nitrophenyl}-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)propanoic acid|3-(3-(4-chlorobenzoyl)-4-hydroxy-2-(4-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)propanoic acid|3-[(3E)-3-[(4-chlorophenyl)(hydroxy)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]propanoic acid|3-[(3E)-3-[(4-chlorophenyl)-hydroxymethylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]propanoic acid|3-[3-(4-CHLOROBENZOYL)-4-HYDROXY-2-(4-NITROPHENYL)-5-OXO-2,5-DIHYDRO-1H-PYRROL-1-YL]PROPANOIC ACID

Molecular Formula	C20H15ClN2O7
Molecular Weight	430.0568 g/mol
LogP	3.1446
Topological Polar Surface Area	138.05 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	430.0568
Monoisotopic Mass	430.0568
Heavy Atoms	30
Complexity	1061.5675

Chemical Identifiers

CAS Number	431069-21-5
SMILES	C1=CC(=CC=C1C2/C(=C(/C3=CC=C(C=C3)Cl)\O)/C(=O)C(=O)N2CCC(=O)O)[N+](=O)[O-]