(2R)-1-[(2R,4R)-5-Ethoxy-2,4-Dimethyl-5-Oxopentanoyl]-2-Indolinecarboxylic Acid

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Properties Simple | Detailed

Formula C18H23NO5
IUPAC Name (2r)-1-[(2r,4r)-5-ethoxy-2,4-dimethyl-5-oxo-pentanoyl]indoline-2-carboxylic acid
Molecular Mass 333.379 g·mol−1
Heat of Formation -934.4 ± 16.7 kJ·mol−1
Dipole Moment 2.62 ± 1.08 D
Volume 405.96 Å 3
Surface Area 321.57 Å 2
HOMO Energy -8.73 ± 0.55 eV
LUMO Energy 0.04 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-1-[(2r,4r)-5-ethoxy-2,4-dimethyl-1,5-dioxopentyl]-2-indolinecarboxylic acid
  • (2r)-1-[(2r,4r)-5-ethoxy-2,4-dimethyl-5-oxo-pentanoyl]-2,3-dihydroindole-2-carboxylic acid
  • (2r)-1-[(2r,4r)-5-ethoxy-2,4-dimethyl-5-oxo-pentanoyl]indoline-2-carboxylic acid
  • (2r)-1-[(2r,4r)-5-ethoxy-2,4-dimethyl-5-oxopentanoyl]-2,3-dihydroindole-2-carboxylic acid
  • (2r)-1-[(2r,4r)-5-ethoxy-5-keto-2,4-dimethyl-pentanoyl]indoline-2-carboxylic acid
  • 1h-indole-1-pentanoic acid, 2-carboxy-2,3-dihydro-alpha,gamma-dimethyl-delta-oxo-, ethyl ester, (2s-(1(alphas*,gammas*),2r*))-
  • cgs 13945
  • ethyl (alphar,gammar,2s)-2-carboxy-alpha,gamma-dimethyl-delta-oxo-1-indolinevalerate
  • pentopril
  • pentoprilum [latin]
CAS Number(s)
  • 82924-03-6
InChIKey NVXFXLSOGLFXKQ-LALPHHSUSA-N
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