Vitas-M small molecule compound
4-[(E)-{2-[(3-bromophenyl)carbonyl]hydrazinylidene}methyl]-2-methoxy-3-nitrophenyl acetate
Catalog ID
STK249364
SMILES COc1c(ccc(c1[N+](=O)[O-])/C=N/NC(=O)c1cccc(c1)Br)OC(=O)C
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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 C17H14BrN3O6 MW 436.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14BrN3O6/c1-10(22)27-14-7-6-12(15(21(24)25)16(14)26-2)9-19-20-17(23)11-4-3-5-13(18)8-11/h3-9H,1-2H3,(H,20,23)/b19-9+InChIKey
ATBAJMNRFOXDNL-DJKKODMXSA-NSynonyms
(4((E)((3bromobenzoyl)hydrazinylidene)methyl)2methoxy3nitrophenyl)acetate
4((E)(2((3bromophenyl)carbonyl)hydrazinylidene)methyl)2methoxy3nitrophenylacetate
CC(=O)OC1=C(C(=C(C=C1)C=NNC(=O)C2=CC(=CC=C2)Br)(N+)(=O)(O))OC
COc1c(ccc(c1(N+)(=O)(O))C=NNC(=O)c1cccc(c1)Br)OC(=O)C
InChI=1SC17H14BrN3O6c110(22)27147612(15(21(24)25)16(14)262)9192017(23)1143513(18)811h39H12H3(H2023)b199+
MFCD08685030
ZINC000009668325
ZINC98031344
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