Vitas-M small molecule compound
2-bromo-4-[(E)-{2-[(2-bromo-4-methoxyphenoxy)acetyl]hydrazinylidene}methyl]phenyl 4-nitrobenzoate
Catalog ID
STK671827
SMILES COc1ccc(c(c1)Br)OCC(=O)N/N=C/c1ccc(c(c1)Br)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 C23H17Br2N3O7 MW 607.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17Br2N3O7/c1-33-17-7-9-20(19(25)11-17)34-13-22(29)27-26-12-14-2-8-21(18(24)10-14)35-23(30)15-3-5-16(6-4-15)28(31)32/h2-12H,13H2,1H3,(H,27,29)/b26-12+InChIKey
PDICVYLWEQBEBU-RPPGKUMJSA-NSynonyms
(2bromo4((E)((2(2bromo4methoxyphenoxy)acetyl)hydrazinylidene)methyl)phenyl)4nitrobenzoate
2bromo4((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)Br
COc1ccc(c(c1)Br)OCC(=O)NN=Cc1ccc(c(c1)Br)OC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC23H17Br2N3O7c133177920(19(25)1117)341322(29)272612142821(18(24)1014)3523(30)153516(6415)28(31)32h212H13H21H3(H2729)b2612+
MFCD00821333
ZINC000098001657
ZINC102776372
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