(4R)-4-({3-[2-(Dimethylamino)Ethyl]-1H-Indol-5-Yl}Methyl)-1,3-Oxazolidin-2-One

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Properties Simple | Detailed

Formula C16H21N3O2
IUPAC Name (4r)-4-[[3-[2-(dimethylamino)ethyl]indol-1-ium-5-yl]methyl]oxazolidin-2-one
Molecular Mass 287.357 g·mol−1
Heat of Formation -216.6 ± 16.7 kJ·mol−1
Dipole Moment 6.65 ± 1.08 D
Volume 359.08 Å 3
Surface Area 303.02 Å 2
HOMO Energy -8.54 ± 0.55 eV
LUMO Energy -0.63 ± eV
Point Group Symmetry C1
Synonyms
  • (4r)-4-[[3-(2-dimethylaminoethyl)-1h-indol-5-yl]methyl]-1,3-oxazolidin-2-one
  • (4r)-4-[[3-(2-dimethylaminoethyl)-1h-indol-5-yl]methyl]-2-oxazolidinone
  • (4r)-4-[[3-(2-dimethylaminoethyl)-1h-indol-5-yl]methyl]oxazolidin-2-one
  • 311c90
  • d00415
  • zolmitriptan
  • zolmitriptan (jan/usan/inn)
CAS Number(s)
  • 139264-17-8
InChIKey ULSDMUVEXKOYBU-CYBMUJFWSA-N
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