Vitas-M small molecule compound

ethyl 1-oxo-2-(propan-2-yl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate

Catalog ID
STK384130
SMILES CCOC(=O)C1C2C=CC3(C1C(=O)N(C3)C(C)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 C14H19NO4 MW 265.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H19NO4/c1-4-18-13(17)10-9-5-6-14(19-9)7-15(8(2)3)12(16)11(10)14/h5-6,8-11H,4,7H2,1-3H3
InChIKey
AEDVTSVCGQKNTJ-UHFFFAOYSA-N
Synonyms

(3aS6R7aR)ethyl2isopropyl1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
CCOC(=O)C1(C@H)2C=C(C@@)3((C@@H)1C(=O)N(C3)C(C)C)O2
ethyl1oxo2(propan2yl)123677ahexahydro3a6epoxyisoindole7carboxylate
InChI=1SC14H19NO4c141813(17)1095614(199)715(8(2)3)12(16)11(10)14h56811H47H213H3
MFCD04041463
ZINC000141620771
ZINC000238997310

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Available files

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