CHEBI:83430 - (E)-flumorph

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (E)-flumorph
ChEBI ID CHEBI:83430
ChEBI ASCII Name (E)-flumorph
Definition An enamide resulting from the formal condensation of (2E)-3-(4-fluorophenyl)-3-(3,4-dimethoxyphenyl)acrylic acid with the amino group of morpholine.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C21H22FNO4
Net Charge 0
Average Mass 371.40210
Monoisotopic Mass 371.15329
InChI InChI=1S/C21H22FNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+
InChIKey BKBSMMUEEAWFRX-NBVRZTHBSA-N
SMILES COc1ccc(cc1OC)C(=C\C(=O)N1CCOCC1)\c1ccc(F)cc1
ChEBI Ontology
Outgoing (E)-flumorph (CHEBI:83430) is a aromatic ether (CHEBI:35618)
(E)-flumorph (CHEBI:83430) is a enamide (CHEBI:51751)
(E)-flumorph (CHEBI:83430) is a morpholines (CHEBI:38785)
(E)-flumorph (CHEBI:83430) is a organofluorine compound (CHEBI:37143)
(E)-flumorph (CHEBI:83430) is a tertiary carboxamide (CHEBI:140326)
Incoming flumorph (CHEBI:83428) has part (E)-flumorph (CHEBI:83430)
IUPAC Name
(2E)-3-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-1-(morpholin-4-yl)prop-2-en-1-one
Registry Number Type Source
14811005 Reaxys Registry Number Reaxys
Last Modified
07 March 2018