Vitas-M small molecule compound

3-{[(2,5-dimethylphenoxy)acetyl]amino}-2-methylbenzoic acid

Catalog ID
STK224555
SMILES O=C(Nc1cccc(c1C)C(=O)O)COc1cc(C)ccc1C

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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 C18H19NO4 MW 313.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO4/c1-11-7-8-12(2)16(9-11)23-10-17(20)19-15-6-4-5-14(13(15)3)18(21)22/h4-9H,10H2,1-3H3,(H,19,20)(H,21,22)
InChIKey
YLMQAIPYZOSSFQ-UHFFFAOYSA-N
Synonyms

3(((25dimethylphenoxy)acetyl)amino)2methylbenzoicacid
3((2(25DIMETHYLPHENOXY)ACETYL)AMINO)2METHYLBENZOICACID
3(2(25DIMETHYLPHENOXY)ACETYLAMINO)2METHYLBENZOICACID
CC1=CC(=C(C=C1)C)OCC(=O)NC2=CC=CC(=C2C)C(=O)O
InChI=1SC18H19NO4c1117812(2)16(911)231017(20)191564514(13(15)3)18(21)22h49H10H213H3(H1920)(H2122)
MFCD03780505
ZINC000004826733
ZINC4826733

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.