CHEBI:115120 - 2-(4-bromophenoxy)acetic acid (5-phenyl-1,3,4-oxadiazol-2-yl)methyl ester

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ChEBI Name 2-(4-bromophenoxy)acetic acid (5-phenyl-1,3,4-oxadiazol-2-yl)methyl ester
ChEBI ID CHEBI:115120
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C17H13BrN2O4
Net Charge 0
Average Mass 389.200
Monoisotopic Mass 388.00587
InChI InChI=1S/C17H13BrN2O4/c18-13-6-8-14(9-7-13)22-11-16(21)23-10-15-19-20-17(24-15)12-4-2-1-3-5-12/h1-9H,10-11H2
InChIKey XYHGIDNNAFOFSL-UHFFFAOYSA-N
SMILES C1=CC=C(C=C1)C2=NN=C(O2)COC(=O)COC3=CC=C(C=C3)Br
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing 2-(4-bromophenoxy)acetic acid (5-phenyl-1,3,4-oxadiazol-2-yl)methyl ester (CHEBI:115120) is a monocarboxylic acid (CHEBI:25384)
Manual Xref Database
LSM-26581 LINCS
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