Vitas-M small molecule compound
2-(2,4-dichlorophenyl)-5,8-dinitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STL294644
SMILES Clc1ccc(c(c1)Cl)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 C18H7Cl2N3O6 MW 432.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H7Cl2N3O6/c19-9-1-2-15(14(20)5-9)21-17(24)12-6-10(22(26)27)3-8-4-11(23(28)29)7-13(16(8)12)18(21)25/h1-7HInChIKey
UTGHQOLOUCMCEN-UHFFFAOYSA-NSynonyms
2(24dichlorophenyl)58dinitro1Hbenzo(de)isoquinoline13(2H)dione
2(24DICHLOROPHENYL)58DINITROBENZO(DE)ISOQUINOLINE13DIONE
C1=CC(=C(C=C1Cl)Cl)N2C(=O)C3=CC(=CC4=CC(=CC(=C43)C2=O)(N+)(=O)(O))(N+)(=O)(O)
Clc1ccc(c(c1)Cl)n1c(=O)c2cc(cc3c2c(c1=O)cc(c3)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC18H7Cl2N3O6c1991215(14(20)59)2117(24)12610(22(26)27)38411(23(28)29)713(16(8)12)18(21)25h17H
MFCD00339183
ZINC000016385044
ZINC16385044
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