Vitas-M small molecule compound
2-(4,5-dimethyl-2-nitrophenyl)-8-(propan-2-ylidene)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Catalog ID
STK006806
SMILES O=C1C2C3C=CC(C2C(=O)N1c1cc(C)c(cc1[N+](=O)[O-])C)C3=C(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 C20H20N2O4 MW 352.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O4/c1-9(2)16-12-5-6-13(16)18-17(12)19(23)21(20(18)24)14-7-10(3)11(4)8-15(14)22(25)26/h5-8,12-13,17-18H,1-4H3InChIKey
YFAFYCQLEMIPJQ-UHFFFAOYSA-NSynonyms
2(45DIMETHYL2NITROPHENYL)8(PROPAN2YLIDENE)3A477ATETRAHYDRO1H47METHANOISOINDOLE13(2H)DIONE
CC1=CC(=C(C=C1C)(N+)(=O)(O))N2C(=O)C3C4C=CC(C3C2=O)C4=C(C)C
InChI=1SC20H20N2O4c19(2)16125613(16)1817(12)19(23)21(20(18)24)14710(3)11(4)815(14)22(25)26h5812131718H14H3
MFCD03141972
O=C1C2C3C=CC(C2C(=O)N1c1cc(C)c(cc1(N+)(=O)(O))C)C3=C(C)C
STK006806
ZINC000100237455
ZINC000229898056
Check stock
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