Vitas-M small molecule compound
ethyl 2-(4-methylbenzyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Catalog ID
STK384166
SMILES CCOC(=O)C1C2C=CC3(C1C(=O)N(C3)Cc1ccc(cc1)C)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 C19H21NO4 MW 327.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21NO4/c1-3-23-18(22)15-14-8-9-19(24-14)11-20(17(21)16(15)19)10-13-6-4-12(2)5-7-13/h4-9,14-16H,3,10-11H2,1-2H3InChIKey
ZRPJZVCYFPIXTC-UHFFFAOYSA-NSynonyms
(3aS6R7aR)ethyl2(4methylbenzyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
CCOC(=O)C1(C@H)2C=C(C@@)3((C@@H)1C(=O)N(C3)Cc1ccc(cc1)C)O2
CCOC(=O)C1C2C=CC3(C1C(=O)N(C3)CC4=CC=C(C=C4)C)O2
ethyl2(4methylbenzyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
InChI=1SC19H21NO4c132318(22)15148919(2414)1120(17(21)16(15)19)10136412(2)5713h491416H31011H212H3
MFCD03828317
ZINC000100846497
ZINC000239439283
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