Vitas-M small molecule compound

2-(4-ethoxyphenyl)-5-methylhexahydro-1H-isoindole-1,3(2H)-dione

Catalog ID
STK269194
SMILES CCOc1ccc(cc1)N1C(=O)C2C(C1=O)CC(CC2)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 C17H21NO3 MW 287.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21NO3/c1-3-21-13-7-5-12(6-8-13)18-16(19)14-9-4-11(2)10-15(14)17(18)20/h5-8,11,14-15H,3-4,9-10H2,1-2H3
InChIKey
RMBROLJLMVLWBP-UHFFFAOYSA-N
Synonyms

(3AS5S7AR)2(4ETHOXYPHENYL)5METHYLHEXAHYDRO1HISOINDOLE13(2H)DIONE
2(4ethoxyphenyl)5methyl3a45677ahexahydroisoindole13dione
2(4ethoxyphenyl)5methylhexahydro1Hisoindole13(2H)dione
CCOC1=CC=C(C=C1)N2C(=O)C3CCC(CC3C2=O)C
InChI=1SC17H21NO3c1321137512(6813)1816(19)149411(2)1015(14)17(18)20h58111415H34910H212H3
MFCD02020303
ZINC000100624399
ZINC000239403077

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Available files

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