Vitas-M small molecule compound

2-bromo-N'-{(E)-[3-(2,4-dinitrophenoxy)phenyl]methylidene}benzohydrazide

Catalog ID
STK220574
SMILES [O-][N+](=O)c1cc(ccc1Oc1cccc(c1)/C=N/NC(=O)c1ccccc1Br)[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 C20H13BrN4O6 MW 485.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13BrN4O6/c21-17-7-2-1-6-16(17)20(26)23-22-12-13-4-3-5-15(10-13)31-19-9-8-14(24(27)28)11-18(19)25(29)30/h1-12H,(H,23,26)/b22-12+
InChIKey
MANDQUIOLJTSFF-WSDLNYQXSA-N
Synonyms

(O)(N+)(=O)c1cc(ccc1Oc1cccc(c1)C=NNC(=O)c1ccccc1Br)(N+)(=O)(O)
2bromoN((E)(3(24dinitrophenoxy)phenyl)methylidene)benzohydrazide
2bromoN((E)(3(24dinitrophenoxy)phenyl)methylideneamino)benzamide
C1=CC=C(C(=C1)C(=O)NN=CC2=CC(=CC=C2)OC3=C(C=C(C=C3)(N+)(=O)(O))(N+)(=O)(O))Br
InChI=1SC20H13BrN4O6c2117721616(17)20(26)2322121343515(1013)31199814(24(27)28)1118(19)25(29)30h112H(H2326)b2212+
MFCD02911321
ZINC000010060101
ZINC96893046

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Available files

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