Vitas-M small molecule compound

dimethyl 2-{[(3,4-dimethylphenoxy)acetyl]amino}benzene-1,4-dicarboxylate

Catalog ID
STK276341
SMILES COC(=O)c1ccc(cc1NC(=O)COc1ccc(c(c1)C)C)C(=O)OC

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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 C20H21NO6 MW 371.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO6/c1-12-5-7-15(9-13(12)2)27-11-18(22)21-17-10-14(19(23)25-3)6-8-16(17)20(24)26-4/h5-10H,11H2,1-4H3,(H,21,22)
InChIKey
UNMVITNWPGYHIG-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)OCC(=O)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC)C
dimethyl2(((34dimethylphenoxy)acetyl)amino)benzene14dicarboxylate
DIMETHYL2((2(34DIMETHYLPHENOXY)ACETYL)AMINO)BENZENE14DICARBOXYLATE
InChI=1SC20H21NO6c1125715(913(12)2)271118(22)21171014(19(23)253)6816(17)20(24)264h510H11H214H3(H2122)
MFCD02342070
ZINC000005101951
ZINC05101951
ZINC5101951

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Available files

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