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

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Formula C26H36N2O3
IUPAC Name (2r)-2-(3,4-dimethoxyphenyl)-2-isopropyl-5-[2-(3-methoxyphenyl)ethyl-methyl-amino]pentanenitrile
Molecular Mass 424.576 g·mol−1
Heat of Formation -317.1 ± 16.7 kJ·mol−1
Dipole Moment 3.98 ± 1.08 D
Volume 573.96 Å 3
Surface Area 438.73 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy 0.07 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-2-(3,4-dimethoxyphenyl)-2-isopropyl-5-[2-(3-methoxyphenyl)ethyl-methyl-amino]pentanenitrile
  • (2r)-2-(3,4-dimethoxyphenyl)-2-isopropyl-5-[2-(3-methoxyphenyl)ethyl-methyl-amino]valeronitrile
  • (2r)-2-(3,4-dimethoxyphenyl)-2-isopropyl-5-[2-(3-methoxyphenyl)ethyl-methylamino]pentanenitrile
  • (2r)-2-(3,4-dimethoxyphenyl)-5-[2-(3-methoxyphenyl)ethyl-methyl-amino]-2-propan-2-yl-pentanenitrile
  • (2r)-2-(3,4-dimethoxyphenyl)-5-[2-(3-methoxyphenyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile
InChIKey VMVKIDPOEOLUFS-AREMUKBSSA-N
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