Vitas-M small molecule compound
2-[3-(2,4-dichlorophenoxy)-5-nitrophenyl]hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Catalog ID
STK311457
SMILES Clc1ccc(c(c1)Cl)Oc1cc(cc(c1)[N+](=O)[O-])N1C(=O)C2C(C1=O)C1OC2CC1
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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 C20H14Cl2N2O6 MW 449.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14Cl2N2O6/c21-9-1-2-14(13(22)5-9)29-12-7-10(6-11(8-12)24(27)28)23-19(25)17-15-3-4-16(30-15)18(17)20(23)26/h1-2,5-8,15-18H,3-4H2InChIKey
HREGPZMTQIRBRK-UHFFFAOYSA-NSynonyms
1052566-85-41052566854
2(3(24dichlorophenoxy)5nitrophenyl)3a45677ahexahydrooctahydro1H47epoxyisoindole13dione
2(3(24dichlorophenoxy)5nitrophenyl)hexahydro1H47epoxyisoindole13(2H)dione
C1CC2C3C(C1O2)C(=O)N(C3=O)C4=CC(=CC(=C4)OC5=C(C=C(C=C5)Cl)Cl)(N+)(=O)(O)
Clc1ccc(c(c1)Cl)Oc1cc(cc(c1)(N+)(=O)(O))N1C(=O)C2C(C1=O)C1OC2CC1
InChI=1SC20H14Cl2N2O6c2191214(13(22)59)2912710(611(812)24(27)28)2319(25)17153416(3015)18(17)20(23)26h12581518H34H2
MFCD04137937
ZINC000103155153
ZINC000103155158
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