Vitas-M small molecule compound

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

Catalog ID
STK372153
SMILES CCCCOC(=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 C20H19NO4 MW 337.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19NO4/c1-3-4-11-25-20(24)14-9-10-15-16(12-14)19(23)21(18(15)22)17-8-6-5-7-13(17)2/h5-10,12H,3-4,11H2,1-2H3
InChIKey
YPRDTAIQBBNZTJ-UHFFFAOYSA-N
Synonyms

13DIOXO2OTOLYL23DIHYDRO1HISOINDOLE5CARBOXYLICACIDBUTYLESTER
butyl2(2methylphenyl)13dioxo23dihydro1Hisoindole5carboxylate
BUTYL2(2METHYLPHENYL)13DIOXOBENZO(34C)AZOLIDINE5CARBOXYLATE
BUTYL2(2METHYLPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
CCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=CC=C3C
InChI=1SC20H19NO4c134112520(24)149101516(1214)19(23)21(18(15)22)17865713(17)2h51012H3411H212H3
MFCD00591913
ZINC000002031574
ZINC02031574
ZINC2031574

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Available files

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