Terminology Service for NFDI4Health
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flucythrinate

Go to external page http://purl.obolibrary.org/obo/CHEBI_34763

Term info

Label

flucythrinate

Synonyms
  • Flucythrinate
  • cyano(3-phenoxyphenyl)methyl (2S)-2-[4-(difluoromethoxy)phenyl]-3-methylbutanoate
database cross reference
Subsets

3_STAR

IUPAC NAME
cyano(3-phenoxyphenyl)methyl (2S)-2-[4-(difluoromethoxy)phenyl]-3-methylbutanoate [ IUPAC ]

charge

0

formula

C26H23F2NO4

has obo namespace

chebi_ontology

has related synonym

(+-)-cyano-(3-phenoxyphenyl)methyl (+)-4-(difluoromethoxy)-alpha-(1-methylethyl)benzeneacetate

id

CHEBI:34763

inchi

InChI=1S/C26H23F2NO4/c1-17(2)24(18-11-13-21(14-12-18)32-26(27)28)25(30)33-23(16-29)19-7-6-10-22(15-19)31-20-8-4-3-5-9-20/h3-15,17,23-24,26H,1-2H3/t23?,24-/m0/s1

inchikey

GBIHOLCMZGAKNG-CGAIIQECSA-N

mass

451.46197

monoisotopicmass

451.15951

smiles

CC(C)[C@H](C(=O)OC(C#N)c1cccc(Oc2ccccc2)c1)c1ccc(OC(F)F)cc1