Vitas-M small molecule compound
2-(4-methylphenyl)-5,8-dinitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STL295218
SMILES Cc1ccc(cc1)n1c(=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 C19H11N3O6 MW 377.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H11N3O6/c1-10-2-4-12(5-3-10)20-18(23)15-8-13(21(25)26)6-11-7-14(22(27)28)9-16(17(11)15)19(20)24/h2-9H,1H3InChIKey
PEWWCHXFEKRMFL-UHFFFAOYSA-NSynonyms
2(4methylphenyl)58dinitro1Hbenzo(de)isoquinoline13(2H)dione
2(4METHYLPHENYL)58DINITROBENZO(DE)ISOQUINOLINE13DIONE
58DINITRO2PTOLYLBENZO(DE)ISOQUINOLINE13DIONE
CC1=CC=C(C=C1)N2C(=O)C3=CC(=CC4=CC(=CC(=C43)C2=O)(N+)(=O)(O))(N+)(=O)(O)
Cc1ccc(cc1)n1c(=O)c2cc(cc3c2c(c1=O)cc(c3)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC19H11N3O6c1102412(5310)2018(23)15813(21(25)26)611714(22(27)28)916(17(11)15)19(20)24h29H1H3
MFCD00349160
ZINC000003158527
ZINC03158527
ZINC3158527
Check stock
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