Vitas-M small molecule compound
2-(4-methyl-2-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
Catalog ID
STK281874
SMILES Cc1ccc(c(c1)[N+](=O)[O-])N1C(=O)C2C(C1=O)C1CCC2C=C1
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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 C17H16N2O4 MW 312.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O4/c1-9-2-7-12(13(8-9)19(22)23)18-16(20)14-10-3-4-11(6-5-10)15(14)17(18)21/h2-4,7-8,10-11,14-15H,5-6H2,1H3InChIKey
BVUUQMPZCQAOIE-UHFFFAOYSA-NSynonyms
2(4methyl2nitrophenyl)3a477atetrahydro1H47ethanoisoindole13(2H)dione
2(4METHYL2NITROPHENYL)3A477ATETRAHYDRO1H47ETHANOISOINDOLE13DIONE
CC1=CC(=C(C=C1)N2C(=O)C3C4CCC(C3C2=O)C=C4)(N+)(=O)(O)
Cc1ccc(c(c1)(N+)(=O)(O))N1C(=O)C2C(C1=O)C1CCC2C=C1
InChI=1SC17H16N2O4c192712(13(89)19(22)23)1816(20)14103411(6510)15(14)17(18)21h247810111415H56H21H3
MFCD00763245
ZINC000100171810
ZINC000101356461
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