Vitas-M small molecule compound
4,7-dimethyl-2-(4-methyl-2-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Catalog ID
STL387154
SMILES Cc1ccc(c(c1)[N+](=O)[O-])N1C(=O)C2C(C1=O)C1(OC2(C)C=C1)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 C17H16N2O5 MW 328.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O5/c1-9-4-5-10(11(8-9)19(22)23)18-14(20)12-13(15(18)21)17(3)7-6-16(12,2)24-17/h4-8,12-13H,1-3H3InChIKey
FAJXRCJOTANMSV-UHFFFAOYSA-NSynonyms
47dimethyl2(4methyl2nitrophenyl)3a477atetrahydro1H47epoxyisoindole13(2H)dione
47dimethyl2(4methyl2nitrophenyl)3a7adihydrooctahydro1H47epoxyisoindole13dione
CC1=CC(=C(C=C1)N2C(=O)C3C(C2=O)C4(C=CC3(O4)C)C)(N+)(=O)(O)
Cc1ccc(c(c1)(N+)(=O)(O))N1C(=O)C2C(C1=O)C1(OC2(C)C=C1)C
InChI=1SC17H16N2O5c194510(11(89)19(22)23)1814(20)1213(15(18)21)17(3)7616(122)2417h481213H13H3
MFCD00292500
ZINC000226627693
ZINC000226627708
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