Vitas-M small molecule compound
5-bromo-2-{[(3,5-dimethylphenoxy)acetyl]amino}benzoic acid
Catalog ID
STK277142
SMILES O=C(Nc1ccc(cc1C(=O)O)Br)COc1cc(C)cc(c1)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H16BrNO4 MW 378.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16BrNO4/c1-10-5-11(2)7-13(6-10)23-9-16(20)19-15-4-3-12(18)8-14(15)17(21)22/h3-8H,9H2,1-2H3,(H,19,20)(H,21,22)InChIKey
WOKMABCMZUGSED-UHFFFAOYSA-NSynonyms
5bromo2(((35dimethylphenoxy)acetyl)amino)benzoicacid
5BROMO2((2(35DIMETHYLPHENOXY)ACETYL)AMINO)BENZOICACID
CC1=CC(=CC(=C1)OCC(=O)NC2=C(C=C(C=C2)Br)C(=O)O)C
InChI=1SC17H16BrNO4c110511(2)713(610)23916(20)19154312(18)814(15)17(21)22h38H9H212H3(H1920)(H2122)
MFCD06091762
ZINC000002879837
ZINC2879837
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