Vitas-M small molecule compound

3-oxo-2-(4-phenylbutan-2-yl)-2,3-dihydro-1H-isoindol-1-yl acetate

Catalog ID
STK052213
SMILES CC(=O)OC1N(C(CCc2ccccc2)C)C(=O)c2c1cccc2

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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 C20H21NO3 MW 323.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO3/c1-14(12-13-16-8-4-3-5-9-16)21-19(23)17-10-6-7-11-18(17)20(21)24-15(2)22/h3-11,14,20H,12-13H2,1-2H3
InChIKey
QWMWZEMANMVJOO-UHFFFAOYSA-N
Synonyms

(3OXO2(4PHENYLBUTAN2YL)1HISOINDOL1YL)ACETATE
3OXO2(4PHENYLBUTAN2YL)23DIHYDRO1HISOINDOL1YLACETATE
CC(=O)OC1N(C(CCc2ccccc2)C)C(=O)c2c1cccc2
CC(CCC1=CC=CC=C1)N2C(C3=CC=CC=C3C2=O)OC(=O)C
InChI=1SC20H21NO3c114(1213168435916)2119(23)1710671118(17)20(21)2415(2)22h3111420H1213H212H3
MFCD08051150
STK052213
ZINC000085722618
ZINC000085722622

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Available files

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