Vitas-M small molecule compound

hexyl 2-(2-methylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate

Catalog ID
STK247150
SMILES CCCCCCOC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccccc1C

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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 C22H23NO4 MW 365.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO4/c1-3-4-5-8-13-27-22(26)16-11-12-17-18(14-16)21(25)23(20(17)24)19-10-7-6-9-15(19)2/h6-7,9-12,14H,3-5,8,13H2,1-2H3
InChIKey
NNJNTBFHVZTRAK-UHFFFAOYSA-N
Synonyms

CCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=CC=C3C
HEXYL2(2METHYLPHENYL)13DIOXO23DIHYDRO1HISOINDOLE5CARBOXYLATE
HEXYL2(2METHYLPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
HEXYL2(2METHYLPHENYL)13DIOXOISOINDOLINE5CARBOXYLATE
InChI=1SC22H23NO4c13458132722(26)1611121718(1416)21(25)23(20(17)24)191076915(19)2h6791214H35813H212H3
MFCD01068328
ZINC000002062984
ZINC02062984
ZINC2062984

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.