Vitas-M small molecule compound
2-(4-chloro-3-nitrophenyl)-2-oxoethyl 2-cyclohexyl-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
Catalog ID
STK269533
SMILES O=C(c1ccc2c(c1)C(=O)N(C2=O)C1CCCCC1)OCC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl
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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 C23H19ClN2O7 MW 470.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19ClN2O7/c24-18-9-7-13(11-19(18)26(31)32)20(27)12-33-23(30)14-6-8-16-17(10-14)22(29)25(21(16)28)15-4-2-1-3-5-15/h6-11,15H,1-5,12H2InChIKey
UXTACTRHSXMCOF-UHFFFAOYSA-NSynonyms
(2(4CHLORO3NITROPHENYL)2OXOETHYL)2CYCLOHEXYL13DIOXOISOINDOLE5CARBOXYLATE
2(4chloro3nitrophenyl)2oxoethyl2cyclohexyl13dioxo23dihydro1Hisoindole5carboxylate
2(4CHLORO3NITROPHENYL)2OXOETHYL2CYCLOHEXYL13DIOXOBENZO(C)AZOLINE5CARBOXYLATE
C1CCC(CC1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC(=O)C4=CC(=C(C=C4)Cl)(N+)(=O)(O)
InChI=1SC23H19ClN2O7c24189713(1119(18)26(31)32)20(27)123323(30)14681617(1014)22(29)25(21(16)28)154213515h61115H1512H2
MFCD02318625
O=C(c1ccc2c(c1)C(=O)N(C2=O)C1CCCCC1)OCC(=O)c1ccc(c(c1)(N+)(=O)(O))Cl
ZINC000001172564
ZINC01172564
ZINC1172564
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