(2S)-2-(3,4-Dimethoxyphenyl)-2-Isopropyl-5-{[2-(3-Methoxyphenyl)Ethyl](Methyl)Amino}Pentanenitrile

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Formula C26H36N2O3
IUPAC Name (2s)-2-(3,4-dimethoxyphenyl)-2-isopropyl-5-[2-(3-methoxyphenyl)ethyl-methyl-amino]pentanenitrile
Molecular Mass 424.576 g·mol−1
Heat of Formation -310.6 ± 16.7 kJ·mol−1
Dipole Moment 4.85 ± 1.08 D
Volume 570.33 Å 3
Surface Area 456.44 Å 2
HOMO Energy -8.52 ± 0.55 eV
LUMO Energy 0.10 ± eV
Point Group Symmetry C1
Synonyms
  • (-)-d 888
  • (-)-desmethoxyverapamil
  • (-)-devapamil
  • (-)-h3-desmethoxyverapamil
  • (2s)-2-(3,4-dimethoxyphenyl)-2-isopropyl-5-[2-(3-methoxyphenyl)ethyl-methyl-amino]pentanenitrile
  • (2s)-2-(3,4-dimethoxyphenyl)-2-isopropyl-5-[2-(3-methoxyphenyl)ethyl-methyl-amino]valeronitrile
  • (2s)-2-(3,4-dimethoxyphenyl)-2-isopropyl-5-[2-(3-methoxyphenyl)ethyl-methylamino]pentanenitrile
  • (2s)-2-(3,4-dimethoxyphenyl)-5-[2-(3-methoxyphenyl)ethyl-methyl-amino]-2-propan-2-yl-pentanenitrile
  • (2s)-2-(3,4-dimethoxyphenyl)-5-[2-(3-methoxyphenyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile
  • 4-desmethoxyverapamil
  • 4-dmv
  • benzeneacetonitrile, 3,4-dimethoxy-alpha-(3-((2-(3-methoxyphenyl)ethyl)methylamino)propyl)-alpha-(1-methylethyl)-, (-)-
  • benzeneacetonitrile, 3,4-dimethoxy-alpha-(3-((2-(3-methoxyphenyl)ethyl)methylamino)propyl)-alpha-(1-methylethyl)-, (s)-
  • d 888
  • d-888
  • d888
  • pdsp1_001086
  • pdsp2_001070
CAS Number(s)
  • 93468-87-2
InChIKey VMVKIDPOEOLUFS-SANMLTNESA-N
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