4-{[(3R)-7-Chloro-2-Oxo-5-Phenyl-2,3-Dihydro-1H-1,4-Benzodiazepin-3-Yl]Oxy}-4-Oxobutanoic Acid

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Properties Simple | Detailed

Formula C19H15ClN2O5
IUPAC Name 4-[[(3r)-7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]oxy]-4-oxo-butanoic acid
Molecular Mass 386.786 g·mol−1
Heat of Formation -642.4 ± 16.7 kJ·mol−1
Dipole Moment 3.35 ± 1.08 D
Volume 423.67 Å 3
Surface Area 378.04 Å 2
HOMO Energy -9.53 ± 0.55 eV
LUMO Energy -1.19 ± eV
Point Group Symmetry C1
Synonyms
  • (-)-rv 1209
  • (r)-oxazepam hemisuccinate
  • 4-[[(3r)-7-chloro-2-keto-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]oxy]-4-keto-butyric acid
  • 4-[[(3r)-7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]oxy]-4-oxo-butanoic acid
  • 4-[[(3r)-7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]oxy]-4-oxobutanoic acid
  • butanedioic acid, mono(7-chloro-2,3-dihydro-2-oxo-5-phenyl-1h-1,4-benzodiazepin-3-yl) ester, (r)-
  • butanedioic acid, mono[(3r)-7-chloro-2,3-dihydro-2-oxo-5-phenyl-1h-1,4-benzodiazepin-3-yl] ester
  • butanedioic acid, mono[(3r)-7-chloro-2,3-dihydro-2-oxo-5-phenyl-1h-1,4-benzodiazepin-3-yl] ester (9ci)
  • l-oxazepam hemisuccinate
  • rv 1209, (-)-
CAS Number(s)
  • 68946-52-1
InChIKey UCUOKZUJHTYPJT-LJQANCHMSA-N
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