Vitas-M small molecule compound
ethyl 1-oxo-2-(1-phenylethyl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Catalog ID
STK384156
SMILES CCOC(=O)C1C2C=CC3(C1C(=O)N(C3)C(c1ccccc1)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)15-14-9-10-19(24-14)11-20(17(21)16(15)19)12(2)13-7-5-4-6-8-13/h4-10,12,14-16H,3,11H2,1-2H3InChIKey
ILQMKZPYGIFLIP-UHFFFAOYSA-NSynonyms
(3aS6R7aR)ethyl1oxo2(1phenylethyl)123677ahexahydro3a6epoxyisoindole7carboxylate
CCOC(=O)C1(C@H)2C=C(C@@)3((C@@H)1C(=O)N(C3)C(c1ccccc1)C)O2
CCOC(=O)C1C2C=CC3(C1C(=O)N(C3)C(C)C4=CC=CC=C4)O2
ethyl1oxo2(1phenylethyl)123677ahexahydro3a6epoxyisoindole7carboxylate
InChI=1SC19H21NO4c132318(22)151491019(2414)1120(17(21)16(15)19)12(2)137546813h410121416H311H212H3
MFCD03849263
ZINC000100846413
ZINC000239310466
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