Vitas-M small molecule compound
2-(2-chlorophenyl)-6,7-dinitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STK750472
SMILES Clc1ccccc1n1c(=O)c2ccc(c3c2c(c1=O)ccc3[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 C18H8ClN3O6 MW 397.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H8ClN3O6/c19-11-3-1-2-4-12(11)20-17(23)9-5-7-13(21(25)26)16-14(22(27)28)8-6-10(15(9)16)18(20)24/h1-8HInChIKey
FWPNTOWKIZFTFR-UHFFFAOYSA-NSynonyms
2(2chlorophenyl)67dinitro1Hbenzo(de)isoquinoline13(2H)dione
2(2CHLOROPHENYL)67DINITROBENZO(DE)ISOQUINOLINE13DIONE
C1=CC=C(C(=C1)N2C(=O)C3=C4C(=CC=C(C4=C(C=C3)(N+)(=O)(O))(N+)(=O)(O))C2=O)Cl
Clc1ccccc1n1c(=O)c2ccc(c3c2c(c1=O)ccc3(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC18H8ClN3O6c1911312412(11)2017(23)95713(21(25)26)1614(22(27)28)8610(15(9)16)18(20)24h18H
MFCD00349151
ZINC000003158523
ZINC03158523
ZINC3158523
Check stock
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Check stock on Vitas-MAvailable files
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