Vitas-M small molecule compound

3,3-dimethyl-2-oxobutyl 2-(2,6-dimethylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate

Catalog ID
STK258507
SMILES O=C(C(C)(C)C)COC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1c(C)cccc1C

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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 C23H23NO5 MW 393.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23NO5/c1-13-7-6-8-14(2)19(13)24-20(26)16-10-9-15(11-17(16)21(24)27)22(28)29-12-18(25)23(3,4)5/h6-11H,12H2,1-5H3
InChIKey
LBLAKTRUWBTQDL-UHFFFAOYSA-N
Synonyms

(33DIMETHYL2OXOBUTYL)2(26DIMETHYLPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
33dimethyl2oxobutyl2(26dimethylphenyl)13dioxo23dihydro1Hisoindole5carboxylate
33DIMETHYL2OXOBUTYL2(26DIMETHYLPHENYL)13DIOXOBENZO(C)AZOLIDINE5CARBOXYLATE
CC1=C(C(=CC=C1)C)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC(=O)C(C)(C)C
InChI=1SC23H23NO5c11376814(2)19(13)2420(26)1610915(1117(16)21(24)27)22(28)291218(25)23(34)5h611H12H215H3
MFCD03037416
ZINC000004545579
ZINC04545579
ZINC4545579

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Available files

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