Vitas-M small molecule compound

2-(3-methoxyphenyl)-2-oxoethyl 4-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)benzoate

Catalog ID
STK275398
SMILES COc1cccc(c1)C(=O)COC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1CC2CC1

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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 C25H23NO6 MW 433.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23NO6/c1-31-19-4-2-3-15(12-19)20(27)13-32-25(30)14-7-9-18(10-8-14)26-23(28)21-16-5-6-17(11-16)22(21)24(26)29/h2-4,7-10,12,16-17,21-22H,5-6,11,13H2,1H3
InChIKey
DGSJUHSUZFXHAL-UHFFFAOYSA-N
Synonyms

2(3methoxyphenyl)2oxoethyl4(13dioxooctahydro2H47methanoisoindol2yl)benzoate
COC1=CC=CC(=C1)C(=O)COC(=O)C2=CC=C(C=C2)N3C(=O)C4C5CCC(C5)C4C3=O
InChI=1SC25H23NO6c1311942315(1219)20(27)133225(30)147918(10814)2623(28)21165617(1116)22(21)24(26)29h247101216172122H561113H21H3
MFCD02915683
ZINC000102081042
ZINC000102081051

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Available files

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