(3R)-3,4-Dihydroxy-2-Methylene-N-(4-{[(2E)-3-Phenyl-2-Propenoyl]Amino}Butyl)Butanamide

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Properties Simple | Detailed

Formula C18H24N2O4
IUPAC Name (3r)-3,4-dihydroxy-2-methylene-n-[4-[[(e)-3-phenylprop-2-enoyl]amino]butyl]butanamide
Molecular Mass 332.394 g·mol−1
Heat of Formation -588.8 ± 16.7 kJ·mol−1
Dipole Moment 4.26 ± 1.08 D
Volume 433.29 Å 3
Surface Area 359.18 Å 2
HOMO Energy -9.56 ± 0.55 eV
LUMO Energy -0.78 ± eV
Point Group Symmetry C1
Synonyms
  • (3r)-3,4-dihydroxy-2-methylene-n-[4-[[(e)-1-oxo-3-phenylprop-2-enyl]amino]butyl]butanamide
  • (3r)-3,4-dihydroxy-2-methylene-n-[4-[[(e)-3-phenylprop-2-enoyl]amino]butyl]butanamide
  • (3r)-3,4-dihydroxy-2-methylidene-n-[4-[[(e)-3-phenylprop-2-enoyl]amino]butyl]butanamide
  • 2-[(1r)-1,2-dihydroxyethyl]-n-[4-[[(e)-3-phenylacryloyl]amino]butyl]acrylamide
InChIKey WOTLWTYQIXFLFZ-SCOAYWHSSA-N
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