Vitas-M small molecule compound

butyl 2-(2-bromophenyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate

Catalog ID
STK384178
SMILES CCCCOC(=O)C1C2C=CC3(C1C(=O)N(C3)c1ccccc1Br)O2

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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 C19H20BrNO4 MW 406.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20BrNO4/c1-2-3-10-24-18(23)15-14-8-9-19(25-14)11-21(17(22)16(15)19)13-7-5-4-6-12(13)20/h4-9,14-16H,2-3,10-11H2,1H3
InChIKey
MHDKNIXLWMBFDU-UHFFFAOYSA-N
Synonyms
1008858-01-2
1008858012
butyl2(2bromophenyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
CCCCOC(=O)C1C2C=CC3(C1C(=O)N(C3)C4=CC=CC=C4Br)O2
InChI=1SC19H20BrNO4c123102418(23)15148919(2514)1121(17(22)16(15)19)13754612(13)20h491416H231011H21H3
MFCD03849270
ZINC000143405672
ZINC000239159535

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Available files

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