Vitas-M small molecule compound
2-(3-methylphenyl)-6,7-dinitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STK699688
SMILES Cc1cccc(c1)n1c(=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 C19H11N3O6 MW 377.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H11N3O6/c1-10-3-2-4-11(9-10)20-18(23)12-5-7-14(21(25)26)17-15(22(27)28)8-6-13(16(12)17)19(20)24/h2-9H,1H3InChIKey
GGYHPXQDCDMBBT-UHFFFAOYSA-NSynonyms
2(3methylphenyl)67dinitro1Hbenzo(de)isoquinoline13(2H)dione
2(3METHYLPHENYL)67DINITROBENZO(DE)ISOQUINOLINE13DIONE
CC1=CC(=CC=C1)N2C(=O)C3=C4C(=CC=C(C4=C(C=C3)(N+)(=O)(O))(N+)(=O)(O))C2=O
Cc1cccc(c1)n1c(=O)c2ccc(c3c2c(c1=O)ccc3(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC19H11N3O6c11032411(910)2018(23)125714(21(25)26)1715(22(27)28)8613(16(12)17)19(20)24h29H1H3
MFCD00349149
ZINC000003158522
ZINC03158522
ZINC3158522
Check stock
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Check stock on Vitas-MAvailable files
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