4-Amino-N-{[(2R)-1-Ethyl-2-Pyrrolidinyl]Methyl}-5-(Ethylsulfonyl)-2-Methoxybenzamide

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Formula C17H27N3O4S
IUPAC Name 4-amino-n-[[(1s,2r)-1-ethylpyrrolidin-2-yl]methyl]-5-ethylsulfonyl-2-methoxy-benzamide
Molecular Mass 369.479 g·mol−1
Heat of Formation -697.5 ± 16.7 kJ·mol−1
Dipole Moment 3.96 ± 1.08 D
Volume 439.73 Å 3
Surface Area 378.98 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy -0.26 ± eV
Point Group Symmetry C1
Synonyms
  • 4-amino-n-[[(2r)-1-ethyl-2-pyrrolidinyl]methyl]-5-ethylsulfonyl-2-methoxybenzamide
  • 4-amino-n-[[(2r)-1-ethylpyrrolidin-2-yl]methyl]-5-ethylsulfonyl-2-methoxy-benzamide
  • 4-amino-n-[[(2r)-1-ethylpyrrolidin-2-yl]methyl]-5-ethylsulfonyl-2-methoxybenzamide
InChIKey NTJOBXMMWNYJFB-GFCCVEGCSA-N
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