Vitas-M small molecule compound
hexyl 2-(4-nitrophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
Catalog ID
STK247167
SMILES CCCCCCOC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(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 C21H20N2O6 MW 396.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O6/c1-2-3-4-5-12-29-21(26)14-6-11-17-18(13-14)20(25)22(19(17)24)15-7-9-16(10-8-15)23(27)28/h6-11,13H,2-5,12H2,1H3InChIKey
YBGADYVBRRBQCN-UHFFFAOYSA-NSynonyms
CCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=C(C=C3)(N+)(=O)(O)
CCCCCCOC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)(N+)(=O)(O)
HEXYL2(4NITROPHENYL)13DIOXO23DIHYDRO1HISOINDOLE5CARBOXYLATE
HEXYL2(4NITROPHENYL)13DIOXOBENZO(C)AZOLINE5CARBOXYLATE
HEXYL2(4NITROPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
InChI=1SC21H20N2O6c12345122921(26)146111718(1314)20(25)22(19(17)24)157916(10815)23(27)28h61113H2512H21H3
MFCD01017615
ZINC000004113413
ZINC04113413
ZINC4113413
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