Vitas-M small molecule compound
2-(4-methyl-2-nitrophenyl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Catalog ID
STL388187
SMILES Cc1ccc(c(c1)[N+](=O)[O-])N1C(=O)C2C(C1=O)C1C=CC2C2C1C2
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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 C18H16N2O4 MW 324.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O4/c1-8-2-5-13(14(6-8)20(23)24)19-17(21)15-9-3-4-10(12-7-11(9)12)16(15)18(19)22/h2-6,9-12,15-16H,7H2,1H3InChIKey
BXVIFRVMCZKCFS-UHFFFAOYSA-NSynonyms
2(4methyl2nitrophenyl)hexahydro46ethenocyclopropa(f)isoindole13(2H3aH)dione
CC1=CC(=C(C=C1)N2C(=O)C3C4C=CC(C3C2=O)C5C4C5)(N+)(=O)(O)
Cc1ccc(c(c1)(N+)(=O)(O))N1C(=O)C2C(C1=O)C1C=CC2C2C1C2
InChI=1SC18H16N2O4c182513(14(68)20(23)24)1917(21)1593410(12711(9)12)16(15)18(19)22h269121516H7H21H3
MFCD01142193
ZINC000239284710
ZINC000239284713
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