Vitas-M small molecule compound
4-methyl-2-(4-methyl-2-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Catalog ID
STL387163
SMILES Cc1ccc(c(c1)[N+](=O)[O-])N1C(=O)C2C(C1=O)C1(OC2C=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 C16H14N2O5 MW 314.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N2O5/c1-8-3-4-9(10(7-8)18(21)22)17-14(19)12-11-5-6-16(2,23-11)13(12)15(17)20/h3-7,11-13H,1-2H3InChIKey
DWBRKRTWHDOAPE-UHFFFAOYSA-NSynonyms
4methyl2(4methyl2nitrophenyl)3a477atetrahydro1H47epoxyisoindole13(2H)dione
7methyl2(4methyl2nitrophenyl)47adihydro3aHoctahydro1H47epoxyisoindole13dione
CC1=CC(=C(C=C1)N2C(=O)C3C4C=CC(C3C2=O)(O4)C)(N+)(=O)(O)
Cc1ccc(c(c1)(N+)(=O)(O))N1C(=O)C2C(C1=O)C1(OC2C=C1)C
InChI=1SC16H14N2O5c18349(10(78)18(21)22)1714(19)12115616(22311)13(12)15(17)20h371113H12H3
MFCD00301296
ZINC000101103906
ZINC000101103910
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