(2E)-3-(3,4-Dimethoxyphenyl)-N-{4-[N''-(3-Methyl-2-Buten-1-Yl)Carbamimidamido]Butyl}Acrylamide

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Properties Simple | Detailed

Formula C21H32N4O3
IUPAC Name (e)-3-(3,4-dimethoxyphenyl)-n-[4-[[(e)-n'-(3-methylbut-2-enyl)carbamimidoyl]amino]butyl]prop-2-enamide
Molecular Mass 388.504 g·mol−1
Heat of Formation -342.6 ± 16.7 kJ·mol−1
Dipole Moment 4.61 ± 1.08 D
Volume 511.55 Å 3
Surface Area 416.65 Å 2
HOMO Energy -8.52 ± 0.55 eV
LUMO Energy -0.55 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-3-(3,4-dimethoxyphenyl)-n-[4-[(n'-(3-methylbut-2-enyl)carbamimidoyl)amino]butyl]acrylamide
  • (e)-3-(3,4-dimethoxyphenyl)-n-[4-[(n'-(3-methylbut-2-enyl)carbamimidoyl)amino]butyl]prop-2-enamide
  • (e)-n-[4-[[amino-(3-methylbut-2-enylimino)methyl]amino]butyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide
  • 1-((3,4-dimethoxycinnamoyl)amino)-4-((3-methyl-2-butenyl)guaidino)butane
  • 2-propenamide, 3-(3,4-dimethoxyphenyl)-n-(4-((imino((3-methyl-2-butenyl)amino)methyl)amino)butyl)-, (e)-
  • caracasanamide
CAS Number(s)
  • 146269-39-8
InChIKey SZQNZZPMXSFUDT-CSKARUKUSA-N
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