CHEBI:182669 - (E)-but-2-enedioic acid;2-[(E)-[5-methoxy-1-[4-(trifluoromethyl)phenyl]pentylidene]amino]oxyethanamine

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ChEBI Name (E)-but-2-enedioic acid;2-[(E)-[5-methoxy-1-[4-(trifluoromethyl)phenyl]pentylidene]amino]oxyethanamine
ChEBI ID CHEBI:182669
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H21F3N2O2.C4H4O4
Net Charge 0
Average Mass 434.412
Monoisotopic Mass 434.16647
InChI InChI=1S/C15H21F3N2O2.C4H4O4/c1-21-10-3-2-4-14(20-22-11-9-19)12-5-7-13(8-6-12)15(16,17)18;5-3(6)1-2-4(7)8/h5-8H,2-4,9-11,19H2,1H3;1-2H,(H,5,6)(H,7,8)/b20-14+;2-1+
InChIKey LFMYNZPAVPMEGP-RJHYFCMPSA-N
SMILES FC(F)(F)C1=CC=C(\C(=N\OCCN)\CCCCOC)C=C1.OC(=O)/C=C/C(O)=O
ChEBI Ontology
Outgoing (E)-but-2-enedioic acid;2-[(E)-[5-methoxy-1-[4-(trifluoromethyl)phenyl]pentylidene]amino]oxyethanamine (CHEBI:182669) is a (trifluoromethyl)benzenes (CHEBI:83565)
IUPAC Name
(E)-but-2-enedioic acid;2-[(E)-[5-methoxy-1-[4-(triluoromethyl)phenyl]pentylidene]amino]oxyethanamine
Manual Xref Database
28572158 ChemSpider
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