Vitas-M small molecule compound
4-[(E)-{2-[(2-bromo-4-nitrophenoxy)acetyl]hydrazinylidene}methyl]-2-methoxyphenyl 3-bromobenzoate
Catalog ID
STK671981
SMILES COc1cc(/C=N/NC(=O)COc2ccc(cc2Br)[N+](=O)[O-])ccc1OC(=O)c1cccc(c1)Br
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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/c1-33-21-9-14(5-7-20(21)35-23(30)15-3-2-4-16(24)10-15)12-26-27-22(29)13-34-19-8-6-17(28(31)32)11-18(19)25/h2-12H,13H2,1H3,(H,27,29)/b26-12+InChIKey
ZMVAGMGXZOELJH-RPPGKUMJSA-NSynonyms
(4((E)((2(2bromo4nitrophenoxy)acetyl)hydrazinylidene)methyl)2methoxyphenyl)3bromobenzoate
4((E)(2((2bromo4nitrophenoxy)acetyl)hydrazinylidene)methyl)2methoxyphenyl3bromobenzoate
COC1=C(C=CC(=C1)C=NNC(=O)COC2=C(C=C(C=C2)(N+)(=O)(O))Br)OC(=O)C3=CC(=CC=C3)Br
COc1cc(C=NNC(=O)COc2ccc(cc2Br)(N+)(=O)(O))ccc1OC(=O)c1cccc(c1)Br
InChI=1SC23H17Br2N3O7c13321914(5720(21)3523(30)1532416(24)1015)12262722(29)1334198617(28(31)32)1118(19)25h212H13H21H3(H2729)b2612+
MFCD00822046
ZINC000100047035
ZINC102776735
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