Vitas-M small molecule compound
2-(4-methoxyphenyl)-6-[(2-nitrobenzyl)oxy]-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STL294856
SMILES COc1ccc(cc1)n1c(=O)c2ccc(c3c2c(c1=O)ccc3)OCc1ccccc1[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 C26H18N2O6 MW 454.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18N2O6/c1-33-18-11-9-17(10-12-18)27-25(29)20-7-4-6-19-23(14-13-21(24(19)20)26(27)30)34-15-16-5-2-3-8-22(16)28(31)32/h2-14H,15H2,1H3InChIKey
YXKOKCPVQMWDRP-UHFFFAOYSA-NSynonyms
2(4methoxyphenyl)6((2nitrobenzyl)oxy)1Hbenzo(de)isoquinoline13(2H)dione
2(4methoxyphenyl)6((2nitrophenyl)methoxy)benzo(de)isoquinoline13dione
COC1=CC=C(C=C1)N2C(=O)C3=C4C(=C(C=C3)OCC5=CC=CC=C5(N+)(=O)(O))C=CC=C4C2=O
COc1ccc(cc1)n1c(=O)c2ccc(c3c2c(c1=O)ccc3)OCc1ccccc1(N+)(=O)(O)
InChI=1SC26H18N2O6c1331811917(101218)2725(29)207461923(141321(24(19)20)26(27)30)341516523822(16)28(31)32h214H15H21H3
MFCD28032794
ZINC000095470862
ZINC95470862
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