CHEBI:106031 - 4-amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile

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ChEBI Name 4-amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile
ChEBI ID CHEBI:106031
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C14H10F5N3O2
Net Charge 0
Average Mass 347.241
Monoisotopic Mass 347.06932
InChI InChI=1S/C14H10F5N3O2/c1-23-7-3-4-8(24-2)11-9(7)10(21)6(5-20)12(22-11)13(15,16)14(17,18)19/h3-4H,1-2H3,(H2,21,22)
InChIKey BGMUZNANPQUDEH-UHFFFAOYSA-N
SMILES COC1=C2C(=C(C(=NC2=C(C=C1)OC)C(C(F)(F)F)(F)F)C#N)N
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing 4-amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile (CHEBI:106031) is a aminoquinoline (CHEBI:36709)
Manual Xref Database
LSM-17392 LINCS
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