Vitas-M small molecule compound
2-(2-hydroxy-4-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK239755
SMILES O=C1C2CC=CCC2C(=O)N1c1ccc(cc1O)[N+](=O)[O-]
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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 C14H12N2O5 MW 288.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N2O5/c17-12-7-8(16(20)21)5-6-11(12)15-13(18)9-3-1-2-4-10(9)14(15)19/h1-2,5-7,9-10,17H,3-4H2InChIKey
LGUKSUMQFBALJX-UHFFFAOYSA-NSynonyms
774189-08-12(2hydroxy4nitrophenyl)3a477atetrahydro1Hisoindole13(2H)dione
2(2hydroxy4nitrophenyl)3a477atetrahydroisoindole13dione
774189081
C1C=CCC2C1C(=O)N(C2=O)C3=C(C=C(C=C3)(N+)(=O)(O))O
InChI=1SC14H12N2O5c171278(16(20)21)5611(12)1513(18)9312410(9)14(15)19h125791017H34H2
MFCD05098767
O=C1C2CC=CCC2C(=O)N1c1ccc(cc1O)(N+)(=O)(O)
ZINC000018227584
ZINC000100396900
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