Vitas-M small molecule compound
2-(2,6-dimethylphenyl)-6,7-dinitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STK750441
SMILES Cc1cccc(c1n1c(=O)c2ccc(c3c2c(c1=O)ccc3[N+](=O)[O-])[N+](=O)[O-])C
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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 C20H13N3O6 MW 391.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13N3O6/c1-10-4-3-5-11(2)18(10)21-19(24)12-6-8-14(22(26)27)17-15(23(28)29)9-7-13(16(12)17)20(21)25/h3-9H,1-2H3InChIKey
GKAJJPNULNJHBW-UHFFFAOYSA-NSynonyms
2(26dimethylphenyl)67dinitro1Hbenzo(de)isoquinoline13(2H)dione
2(26DIMETHYLPHENYL)67DINITROBENZO(DE)ISOQUINOLINE13DIONE
CC1=C(C(=CC=C1)C)N2C(=O)C3=C4C(=CC=C(C4=C(C=C3)(N+)(=O)(O))(N+)(=O)(O))C2=O
Cc1cccc(c1n1c(=O)c2ccc(c3c2c(c1=O)ccc3(N+)(=O)(O))(N+)(=O)(O))C
InChI=1SC20H13N3O6c11043511(2)18(10)2119(24)126814(22(26)27)1715(23(28)29)9713(16(12)17)20(21)25h39H12H3
MFCD00607464
ZINC000003206793
ZINC03206793
ZINC3206793
Check stock
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