Vitas-M small molecule compound

4-[(E)-{2-[(2,6-dibromo-4-methoxyphenoxy)acetyl]hydrazinylidene}methyl]-2-methoxyphenyl 4-nitrobenzoate

Catalog ID
STK672301
SMILES COc1cc(/C=N/NC(=O)COc2c(Br)cc(cc2Br)OC)ccc1OC(=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 C24H19Br2N3O8 MW 637.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19Br2N3O8/c1-34-17-10-18(25)23(19(26)11-17)36-13-22(30)28-27-12-14-3-8-20(21(9-14)35-2)37-24(31)15-4-6-16(7-5-15)29(32)33/h3-12H,13H2,1-2H3,(H,28,30)/b27-12+
InChIKey
VFTCBZBLQUAEGU-KKMKTNMSSA-N
Synonyms

(4((E)((2(26dibromo4methoxyphenoxy)acetyl)hydrazinylidene)methyl)2methoxyphenyl)4nitrobenzoate
4((E)(2((26dibromo4methoxyphenoxy)acetyl)hydrazinylidene)methyl)2methoxyphenyl4nitrobenzoate
COC1=CC(=C(C(=C1)Br)OCC(=O)NN=CC2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)(N+)(=O)(O))OC)Br
COc1cc(C=NNC(=O)COc2c(Br)cc(cc2Br)OC)ccc1OC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC24H19Br2N3O8c134171018(25)23(19(26)1117)361322(30)282712143820(21(914)352)3724(31)154616(7515)29(32)33h312H13H212H3(H2830)b2712+
MFCD00823710
ZINC000098001705
ZINC150637751

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Available files

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