4-Nitro-N-[3-({4-[(4-Nitrobenzoyl)Amino]Butyl}Amino)Propyl]Benzamide

Molecule SVG Image

Properties Simple | Detailed

Formula C21H25N5O6
IUPAC Name 4-nitro-n-[4-[3-[(4-nitrobenzoyl)amino]propylamino]butyl]benzamide
Molecular Mass 443.453 g·mol−1
Heat of Formation -273.6 ± 16.7 kJ·mol−1
Dipole Moment 11.56 ± 1.08 D
Volume 536.16 Å 3
Surface Area 400.1 Å 2
HOMO Energy -9.48 ± 0.55 eV
LUMO Energy -1.58 ± eV
Point Group Symmetry C1
Synonyms
  • 4-(hydroxy(oxido)amino)-n-(4-((3-((4-(hydroxy(oxido)amino)benzoyl)amino)propyl)amino)butyl)benzamide
  • 4-(hydroxy-oxido-amino)-n-[4-[3-[[4-(hydroxy-oxido-amino)benzoyl]amino]propylamino]butyl]benzamide
  • 4-(hydroxy-oxido-amino)-n-[4-[3-[[4-(hydroxy-oxido-amino)phenyl]carbonylamino]propylamino]butyl]benzamide
  • 4-(hydroxy-oxidoamino)-n-[4-[3-[[4-(hydroxy-oxidoamino)benzoyl]amino]propylamino]butyl]benzamide
  • 4-(hydroxy-oxidoamino)-n-[4-[3-[[[4-(hydroxy-oxidoamino)phenyl]-oxomethyl]amino]propylamino]butyl]benzamide
  • 4-nitro-n-[4-[3-[(4-nitrobenzoyl)amino]propylamino]butyl]benzamide
  • 4-nitro-n-[4-[3-[(4-nitrophenyl)carbonylamino]propylamino]butyl]benzamide
  • 4-nitro-n-[4-[3-[[(4-nitrophenyl)-oxomethyl]amino]propylamino]butyl]benzamide
  • b-4-nbsd
  • benzamide, 4-nitro-n-(3-((4-((4-nitrobenzoyl)amino)butyl)amino)propyl)-
  • n-hydroxy-4-[4-[3-[[4-(hydroxy-oxido-ammonio)benzoyl]amino]propylamino]butylcarbamoyl]benzeneamine oxide
  • n-hydroxy-4-[4-[3-[[4-(hydroxy-oxidoazaniumyl)benzoyl]amino]propylamino]butylcarbamoyl]benzeneamine oxide
CAS Number(s)
  • 87581-14-4
InChIKey CITGVVGNJAJBKW-UHFFFAOYSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N