(2-Chloro-5-Cyano-1,3-Phenylene)Bis(Imino-2-Oxo-2,1-Ethanediyl) Diacetate

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Properties Simple | Detailed

Formula C15H14ClN3O6
IUPAC Name [2-[3-[(2-acetoxyacetyl)amino]-2-chloro-5-cyano-anilino]-2-oxo-ethyl] acetate
Molecular Mass 367.741 g·mol−1
Heat of Formation -875.4 ± 16.7 kJ·mol−1
Dipole Moment 4.75 ± 1.08 D
Volume 390.85 Å 3
Surface Area 378.0 Å 2
HOMO Energy -9.40 ± 0.55 eV
LUMO Energy -1.20 ± eV
Point Group Symmetry C2v
Synonyms
  • 3,5-bis(acetoxyacetylamino)-4-chlorobenzonitrile
  • [2-[[3-(2-acetyloxyethanoylamino)-2-chloro-5-cyano-phenyl]amino]-2-oxo-ethyl] ethanoate
  • [2-[[3-[(2-acetoxyacetyl)amino]-2-chloro-5-cyano-phenyl]amino]-2-oxo-ethyl] acetate
  • acetamide, n,n'-(2-chloro-5-cyano-1,3-phenylene)bis(2-(acetyloxy)-
  • acetic acid [2-[[3-[(2-acetoxy-1-oxoethyl)amino]-2-chloro-5-cyanophenyl]amino]-2-oxoethyl] ester
  • acetic acid [2-[[3-[(2-acetoxyacetyl)amino]-2-chloro-5-cyano-phenyl]amino]-2-keto-ethyl] ester
  • acreozast
  • n,n'-(2-chloro-5-cyano-m-phenylene)bis(glycolamide)diacetate (ester)
  • tyb 2285
  • tyb-2285
CAS Number(s)
  • 123548-56-1
InChIKey VNVBCWREJHKWSG-UHFFFAOYSA-N
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