Vitas-M small molecule compound

3-(4-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)phenyl acetate

Catalog ID
STK258453
SMILES CC(=O)Oc1cccc(c1)N1C(=O)C2C(C1=O)C(C)C=CC2

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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 C17H17NO4 MW 299.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO4/c1-10-5-3-8-14-15(10)17(21)18(16(14)20)12-6-4-7-13(9-12)22-11(2)19/h3-7,9-10,14-15H,8H2,1-2H3
InChIKey
SMUNMOZMVLYVAG-UHFFFAOYSA-N
Synonyms

(3(4METHYL13DIOXO3A477ATETRAHYDROISOINDOL2YL)PHENYL)ACETATE
3(4methyl13dioxo133a477ahexahydro2Hisoindol2yl)phenylacetate
CC1C=CCC2C1C(=O)N(C2=O)C3=CC(=CC=C3)OC(=O)C
InChI=1SC17H17NO4c1105381415(10)17(21)18(16(14)20)1264713(912)2211(2)19h379101415H8H212H3
MFCD03186596
ZINC000101597432
ZINC000226381961

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Available files

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