Vitas-M small molecule compound
2-(2-chloro-5-nitrophenyl)-8-(propan-2-ylidene)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Catalog ID
STK260136
SMILES CC(=C1C2C=CC1C1C2C(=O)N(C1=O)c1cc(ccc1Cl)[N+](=O)[O-])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 C18H15ClN2O4 MW 358.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClN2O4/c1-8(2)14-10-4-5-11(14)16-15(10)17(22)20(18(16)23)13-7-9(21(24)25)3-6-12(13)19/h3-7,10-11,15-16H,1-2H3InChIKey
KOVFKYDUXJBVAW-UHFFFAOYSA-NSynonyms
2(2chloro5nitrophenyl)8(propan2ylidene)3a477atetrahydro1H47methanoisoindole13(2H)dione
CC(=C1C2C=CC1C1C2C(=O)N(C1=O)c1cc(ccc1Cl)(N+)(=O)(O))C
CC(=C1C2C=CC1C3C2C(=O)N(C3=O)C4=C(C=CC(=C4)(N+)(=O)(O))Cl)C
InChI=1SC18H15ClN2O4c18(2)14104511(14)1615(10)17(22)20(18(16)23)1379(21(24)25)3612(13)19h3710111516H12H3
MFCD01802278
ZINC000100186887
ZINC000244708162
Check stock
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Check stock on Vitas-MAvailable files
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