Vitas-M small molecule compound

2-bromo-4-{(E)-[2-(phenylcarbonyl)hydrazinylidene]methyl}phenyl 4-nitrobenzoate

Catalog ID
STK747911
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])Oc1ccc(cc1Br)/C=N/NC(=O)c1ccccc1

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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 C21H14BrN3O5 MW 468.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14BrN3O5/c22-18-12-14(13-23-24-20(26)15-4-2-1-3-5-15)6-11-19(18)30-21(27)16-7-9-17(10-8-16)25(28)29/h1-13H,(H,24,26)/b23-13+
InChIKey
FFVFNAWIQRBTNV-YDZHTSKRSA-N
Synonyms

(4((E)(benzoylhydrazinylidene)methyl)2bromophenyl)4nitrobenzoate
2BROMO4((E)(2(PHENYLCARBONYL)HYDRAZINYLIDENE)METHYL)PHENYL4NITROBENZOATE
C1=CC=C(C=C1)C(=O)NN=CC2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)(N+)(=O)(O))Br
InChI=1SC21H14BrN3O5c22181214(13232420(26)154213515)61119(18)3021(27)167917(10816)25(28)29h113H(H2426)b2313+
MFCD00342268
O=C(c1ccc(cc1)(N+)(=O)(O))Oc1ccc(cc1Br)C=NNC(=O)c1ccccc1
ZINC000003169763
ZINC34760260

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Available files

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