Vitas-M small molecule compound

6-[(E)-{2-[4-(2,4-dichlorophenoxy)butanoyl]hydrazinylidene}methyl]-2,3-dimethoxybenzoic acid

Catalog ID
STK525153
SMILES COc1c(OC)ccc(c1C(=O)O)/C=N/NC(=O)CCCOc1ccc(cc1Cl)Cl

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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 C20H20Cl2N2O6 MW 455.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20Cl2N2O6/c1-28-16-7-5-12(18(20(26)27)19(16)29-2)11-23-24-17(25)4-3-9-30-15-8-6-13(21)10-14(15)22/h5-8,10-11H,3-4,9H2,1-2H3,(H,24,25)(H,26,27)/b23-11+
InChIKey
OKMWUZDJDMFPJE-FOKLQQMPSA-N
Synonyms
373373-84-3
(E)6((2(4(24dichlorophenoxy)butanoyl)hydrazono)methyl)23dimethoxybenzoicacid
373373843
6((E)(2(4(24dichlorophenoxy)butanoyl)hydrazinylidene)methyl)23dimethoxybenzoicacid
6((E)(4(24DICHLOROPHENOXY)BUTANOYLHYDRAZINYLIDENE)METHYL)23DIMETHOXYBENZOICACID
COC1=C(C(=C(C=C1)C=NNC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl)C(=O)O)OC
COc1c(OC)ccc(c1C(=O)O)C=NNC(=O)CCCOc1ccc(cc1Cl)Cl
InChI=1SC20H20Cl2N2O6c128167512(18(20(26)27)19(16)292)11232417(25)43930158613(21)1014(15)22h581011H349H212H3(H2425)(H2627)b2311+
MFCD01947059
ZINC000002280583
ZINC33352174

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Available files

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