Vitas-M small molecule compound
9-(4-bromo-3-nitrophenyl)-2,2,7,7-tetramethyl-2,3,7,8-tetrahydro-1H-xanthene-4,5(6H,9H)-dione
Catalog ID
STK747061
SMILES O=C1CC(C)(C)CC2=C1OC1=C(C2c2ccc(c(c2)[N+](=O)[O-])Br)CC(CC1=O)(C)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 C23H24BrNO5 MW 474.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24BrNO5/c1-22(2)8-13-19(12-5-6-15(24)16(7-12)25(28)29)14-9-23(3,4)11-18(27)21(14)30-20(13)17(26)10-22/h5-7,19H,8-11H2,1-4H3InChIKey
KLNWZMCTQPAJAO-UHFFFAOYSA-NSynonyms
9(4bromo3nitrophenyl)2277tetramethyl2378tetrahydro1Hxanthene45(6H9H)dione
9(4bromo3nitrophenyl)2277tetramethyl3689tetrahydro1Hxanthene45dione
CC1(CC2=C(C(=O)C1)OC3=C(C2C4=CC(=C(C=C4)Br)(N+)(=O)(O))CC(CC3=O)(C)C)C
InChI=1SC23H24BrNO5c122(2)81319(125615(24)16(712)25(28)29)14923(34)1118(27)21(14)3020(13)17(26)1022h5719H811H214H3
MFCD00732402
O=C1CC(C)(C)CC2=C1OC1=C(C2c2ccc(c(c2)(N+)(=O)(O))Br)CC(CC1=O)(C)C
ZINC000001051509
ZINC01051509
ZINC1051509
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