Vitas-M small molecule compound

4-[(E)-{2-[(3,5-dihydroxyphenyl)carbonyl]hydrazinylidene}methyl]-2-methoxyphenyl benzoate

Catalog ID
STK494221
SMILES COc1cc(/C=N/NC(=O)c2cc(O)cc(c2)O)ccc1OC(=O)c1ccccc1

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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 C22H18N2O6 MW 406.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N2O6/c1-29-20-9-14(7-8-19(20)30-22(28)15-5-3-2-4-6-15)13-23-24-21(27)16-10-17(25)12-18(26)11-16/h2-13,25-26H,1H3,(H,24,27)/b23-13+
InChIKey
IBAJQZZCCHZACD-YDZHTSKRSA-N
Synonyms

(4((E)((35BIS(OXIDANYL)PHENYL)CARBONYLHYDRAZINYLIDENE)METHYL)2METHOXYPHENYL)BENZOATE
(4((E)((35DIHYDROXYBENZOYL)HYDRAZINYLIDENE)METHYL)2METHOXYPHENYL)BENZOATE
4((1E)2((35DIHYDROXYPHENYL)CARBONYLAMINO)2AZAVINYL)2METHOXYPHENYLBENZOATE
4((E)(2((35dihydroxyphenyl)carbonyl)hydrazinylidene)methyl)2methoxyphenylbenzoate
BENZOICACID(4((E)(((35DIHYDROXYPHENYL)OXOMETHYL)HYDRAZINYLIDENE)METHYL)2METHOXYPHENYL)ESTER
BENZOICACID(4((E)((35DIHYDROXYBENZOYL)HYDRAZONO)METHYL)2METHOXYPHENYL)ESTER
COC1=C(C=CC(=C1)C=NNC(=O)C2=CC(=CC(=C2)O)O)OC(=O)C3=CC=CC=C3
COc1cc(C=NNC(=O)c2cc(O)cc(c2)O)ccc1OC(=O)c1ccccc1
InChI=1SC22H18N2O6c12920914(7819(20)3022(28)155324615)13232421(27)161017(25)1218(26)1116h2132526H1H3(H2427)b2313+
MFCD11854250
ZINC000015933642
ZINC60311226

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Available files

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