CHEBI:109223 - 3-[[2-(1-benzotriazolyl)-1-oxoethyl]amino]benzoic acid methyl ester

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ChEBI Name 3-[[2-(1-benzotriazolyl)-1-oxoethyl]amino]benzoic acid methyl ester
ChEBI ID CHEBI:109223
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C16H14N4O3
Net Charge 0
Average Mass 310.308
Monoisotopic Mass 310.10659
InChI InChI=1S/C16H14N4O3/c1-23-16(22)11-5-4-6-12(9-11)17-15(21)10-20-14-8-3-2-7-13(14)18-19-20/h2-9H,10H2,1H3,(H,17,21)
InChIKey WKORLPDHDZUTLF-UHFFFAOYSA-N
SMILES COC(=O)C1=CC(=CC=C1)NC(=O)CN2C3=CC=CC=C3N=N2
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 3-[[2-(1-benzotriazolyl)-1-oxoethyl]amino]benzoic acid methyl ester (CHEBI:109223) is a amidobenzoic acid (CHEBI:48470)
Manual Xref Database
LSM-20620 LINCS
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