Vitas-M small molecule compound

2-(2-bromophenyl)-5,8-dinitro-1H-benzo[de]isoquinoline-1,3(2H)-dione

Catalog ID
STL294642
SMILES Brc1ccccc1n1c(=O)c2cc(cc3c2c(c1=O)cc(c3)[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 C18H8BrN3O6 MW 442.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H8BrN3O6/c19-14-3-1-2-4-15(14)20-17(23)12-7-10(21(25)26)5-9-6-11(22(27)28)8-13(16(9)12)18(20)24/h1-8H
InChIKey
ZYMOXDBDJOEGPW-UHFFFAOYSA-N
Synonyms

2(2bromophenyl)58dinitro1Hbenzo(de)isoquinoline13(2H)dione
2(2BROMOPHENYL)58DINITROBENZO(DE)ISOQUINOLINE13DIONE
Brc1ccccc1n1c(=O)c2cc(cc3c2c(c1=O)cc(c3)(N+)(=O)(O))(N+)(=O)(O)
C1=CC=C(C(=C1)N2C(=O)C3=CC(=CC4=CC(=CC(=C43)C2=O)(N+)(=O)(O))(N+)(=O)(O))Br
InChI=1SC18H8BrN3O6c1914312415(14)2017(23)12710(21(25)26)59611(22(27)28)813(16(9)12)18(20)24h18H
MFCD00349166
ZINC000016450275
ZINC16450275

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Available files

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