Vitas-M small molecule compound

2,3-dimethylphenyl 4-(5-methyl-1,3-dioxooctahydro-2H-isoindol-2-yl)benzoate

Catalog ID
STK253748
SMILES CC1CCC2C(C1)C(=O)N(C2=O)c1ccc(cc1)C(=O)Oc1cccc(c1C)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 C24H25NO4 MW 391.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25NO4/c1-14-7-12-19-20(13-14)23(27)25(22(19)26)18-10-8-17(9-11-18)24(28)29-21-6-4-5-15(2)16(21)3/h4-6,8-11,14,19-20H,7,12-13H2,1-3H3
InChIKey
WNFLSJBHLDTXER-UHFFFAOYSA-N
Synonyms

(23dimethylphenyl)4(5methyl13dioxo3a45677ahexahydroisoindol2yl)benzoate
23dimethylphenyl4(5methyl13dioxooctahydro2Hisoindol2yl)benzoate
CC1CCC2C(C1)C(=O)N(C2=O)C3=CC=C(C=C3)C(=O)OC4=CC=CC(=C4C)C
InChI=1SC24H25NO4c1147121920(1314)23(27)25(22(19)26)1810817(91118)24(28)292164515(2)16(21)3h46811141920H71213H213H3
MFCD02871151
ZINC000018010820
ZINC000101878181

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Available files

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