N,N-Dimethylcarbamoylmethyl-P-(P-Guanidinobenzoyloxy)Phenylacetate

Molecule SVG Image

Properties Simple | Detailed

Formula C20H22N4O5
IUPAC Name [4-[2-[2-(dimethylamino)-2-oxo-ethoxy]-2-oxo-ethyl]phenyl] 4-guanidinobenzoate
Molecular Mass 398.412 g·mol−1
Heat of Formation -604.8 ± 16.7 kJ·mol−1
Dipole Moment 5.01 ± 1.08 D
Volume 465.43 Å 3
Surface Area 432.6 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy -0.68 ± eV
Point Group Symmetry C1
Synonyms
  • 4-guanidinobenzoic acid [4-[2-(2-dimethylamino-2-keto-ethoxy)-2-keto-ethyl]phenyl] ester
  • 4-guanidinobenzoic acid [4-[2-(2-dimethylamino-2-oxoethoxy)-2-oxoethyl]phenyl] ester
  • [4-[2-(2-dimethylamino-2-oxo-ethoxy)-2-oxo-ethyl]phenyl] 4-(diaminomethylideneamino)benzoate
  • [4-[2-(2-dimethylamino-2-oxo-ethoxy)-2-oxo-ethyl]phenyl] 4-guanidinobenzoate
  • [4-[2-(2-dimethylamino-2-oxoethoxy)-2-oxoethyl]phenyl] 4-(diaminomethylideneamino)benzoate
  • camostat
  • p-guanidinobenzoic acid, ester with (p-hydroxyphenyl)acetic acid, ester with n,n-dimethylglycolamide
InChIKey XASIMHXSUQUHLV-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N