Vitas-M small molecule compound
4-[(E)-{2-[(2-bromo-4-methoxyphenoxy)acetyl]hydrazinylidene}methyl]phenyl 4-nitrobenzoate
Catalog ID
STK672455
SMILES COc1ccc(c(c1)Br)OCC(=O)N/N=C/c1ccc(cc1)OC(=O)c1ccc(cc1)[N+](=O)[O-]
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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 C23H18BrN3O7 MW 528.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18BrN3O7/c1-32-19-10-11-21(20(24)12-19)33-14-22(28)26-25-13-15-2-8-18(9-3-15)34-23(29)16-4-6-17(7-5-16)27(30)31/h2-13H,14H2,1H3,(H,26,28)/b25-13+InChIKey
AOSQYFXAJCYDQI-DHRITJCHSA-NSynonyms
(4((E)((2(2bromo4methoxyphenoxy)acetyl)hydrazinylidene)methyl)phenyl)4nitrobenzoate
4((E)(2((2bromo4methoxyphenoxy)acetyl)hydrazinylidene)methyl)phenyl4nitrobenzoate
COC1=CC(=C(C=C1)OCC(=O)NN=CC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)(N+)(=O)(O))Br
COc1ccc(c(c1)Br)OCC(=O)NN=Cc1ccc(cc1)OC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC23H18BrN3O7c13219101121(20(24)1219)331422(28)262513152818(9315)3423(29)164617(7516)27(30)31h213H14H21H3(H2628)b2513+
MFCD00824189
ZINC000003117087
ZINC102777422
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