Vitas-M small molecule compound
2-(4-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK375217
SMILES O=C1C2CC=CCC2C(=O)N1c1ccc(cc1)[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 C14H12N2O4 MW 272.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N2O4/c17-13-11-3-1-2-4-12(11)14(18)15(13)9-5-7-10(8-6-9)16(19)20/h1-2,5-8,11-12H,3-4H2InChIKey
NTINCPQSZRXXQY-UHFFFAOYSA-NSynonyms
2(4nitrophenyl)3a477atetrahydro1Hisoindole13(2H)dione
2(4NITROPHENYL)3A477ATETRAHYDROISOINDOLE13DIONE
2(4NITROPHENYL)473A7ATETRAHYDROISOINDOLE13DIONE
C1C=CCC2C1C(=O)N(C2=O)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC14H12N2O4c171311312412(11)14(18)15(13)95710(869)16(19)20h12581112H34H2
MFCD00523289
O=C1C2CC=CCC2C(=O)N1c1ccc(cc1)(N+)(=O)(O)
ZINC000013475716
ZINC000100399483
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