AC1NT6PA

6-[(3E)-2-(2-fluorophenyl)-3-[hydroxy-(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]hexanoic acid

Also Known As: CBMicro_041282|BAS 01815174|BIM-0041379.P001|SR-01000489767-1|6-[2-(2-FLUOROPHENYL)-4-HYDROXY-3-(4-NITROBENZOYL)-5-OXO-2,5-DIHYDRO-1H-PYRROL-1-YL]HEXANOIC ACID|6-[(3E)-2-(2-fluorophenyl)-3-[hydroxy-(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]hexanoic acid|6-{(3E)-2-(2-Fluorophenyl)-3-[hydroxy(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}hexanoic acid

Molecular Formula	C23H21FN2O7
Molecular Weight	456.13327 g/mol
LogP	3.8006
Topological Polar Surface Area	138.05 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	9
Exact Mass	456.13327
Monoisotopic Mass	456.13327
Heavy Atoms	33
Complexity	1127.8848

Chemical Identifiers

CAS Number	6034-94-2
SMILES	C1=CC=C(C(=C1)C2/C(=C(/C3=CC=C(C=C3)[N+](=O)[O-])\O)/C(=O)C(=O)N2CCCCCC(=O)O)F