Vitas-M small molecule compound

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

Catalog ID
STK374230
SMILES CCCCCCOC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1cccc(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 C22H23NO4 MW 365.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO4/c1-3-4-5-6-12-27-22(26)16-10-11-18-19(14-16)21(25)23(20(18)24)17-9-7-8-15(2)13-17/h7-11,13-14H,3-6,12H2,1-2H3
InChIKey
MBVRTSVEHPWGBG-UHFFFAOYSA-N
Synonyms

CCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=CC(=C3)C
hexyl2(3methylphenyl)13dioxo23dihydro1Hisoindole5carboxylate
HEXYL2(3METHYLPHENYL)13DIOXOBENZO(C)AZOLINE5CARBOXYLATE
HEXYL2(3METHYLPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
InChI=1SC22H23NO4c13456122722(26)1610111819(1416)21(25)23(20(18)24)1797815(2)1317h7111314H3612H212H3
MFCD01017610
ZINC000004113411
ZINC04113411
ZINC4113411

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Available files

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