Vitas-M small molecule compound

4-{(E)-[(4-bromophenyl)imino]methyl}phenyl 3,5-dinitrobenzoate

Catalog ID
STK753866
SMILES Brc1ccc(cc1)/N=C/c1ccc(cc1)OC(=O)c1cc(cc(c1)[N+](=O)[O-])[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 C20H12BrN3O6 MW 470.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12BrN3O6/c21-15-3-5-16(6-4-15)22-12-13-1-7-19(8-2-13)30-20(25)14-9-17(23(26)27)11-18(10-14)24(28)29/h1-12H/b22-12+
InChIKey
OWNNAHBCQPYCJJ-WSDLNYQXSA-N
Synonyms

4((E)((4bromophenyl)imino)methyl)phenyl35dinitrobenzoate
Brc1ccc(cc1)N=Cc1ccc(cc1)OC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O)
MFCD00824746
ZINC000003117347

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.