Vitas-M small molecule compound

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

Catalog ID
STK750473
SMILES [O-][N+](=O)c1cc2cc(cc3c2c(c1)c(=O)n(c3=O)c1ccccn1)[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 C17H8N4O6 MW 364.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H8N4O6/c22-16-12-7-10(20(24)25)5-9-6-11(21(26)27)8-13(15(9)12)17(23)19(16)14-3-1-2-4-18-14/h1-8H
InChIKey
WZLUIXMSKTWXDV-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1cc2cc(cc3c2c(c1)c(=O)n(c3=O)c1ccccn1)(N+)(=O)(O)
58DINITRO2(2PYRIDINYL)BENZO(DE)ISOQUINOLINE13DIONE
58DINITRO2(2PYRIDYL)BENZO(DE)ISOQUINOLINE13QUINONE
58dinitro2(pyridin2yl)1Hbenzo(de)isoquinoline13(2H)dione
58DINITRO2PYRIDIN2YLBENZO(DE)ISOQUINOLINE13DIONE
C1=CC=NC(=C1)N2C(=O)C3=CC(=CC4=CC(=CC(=C43)C2=O)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC17H8N4O6c221612710(20(24)25)59611(21(26)27)813(15(9)12)17(23)19(16)1431241814h18H
MFCD00355508
ZINC000017364048
ZINC17364048

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Available files

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