Vitas-M small molecule compound

2-(2,5-dimethoxyphenyl)-6-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione

Catalog ID
STK530631
SMILES COc1ccc(c(c1)n1c(=O)c2cccc3c2c(c1=O)ccc3[N+](=O)[O-])OC

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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 C20H14N2O6 MW 378.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N2O6/c1-27-11-6-9-17(28-2)16(10-11)21-19(23)13-5-3-4-12-15(22(25)26)8-7-14(18(12)13)20(21)24/h3-10H,1-2H3
InChIKey
YXEBFUJUJUSTSA-UHFFFAOYSA-N
Synonyms

2(25dimethoxyphenyl)6nitro1Hbenzo(de)isoquinoline13(2H)dione
2(25DIMETHOXYPHENYL)6NITROBENZO(DE)ISOQUINOLINE13DIONE
COC1=CC(=C(C=C1)OC)N2C(=O)C3=C4C(=C(C=C3)(N+)(=O)(O))C=CC=C4C2=O
COc1ccc(c(c1)n1c(=O)c2cccc3c2c(c1=O)ccc3(N+)(=O)(O))OC
InChI=1SC20H14N2O6c127116917(282)16(1011)2119(23)135341215(22(25)26)8714(18(12)13)20(21)24h310H12H3
MFCD00227153
ZINC000001300586
ZINC01300586
ZINC1300586

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Available files

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