Vitas-M small molecule compound

N-ethyl-4,7,7-trimethyl-N-(3-methylphenyl)-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxamide

Catalog ID
STK965216
SMILES CCN(C(=O)C12CCC(C2(C)C)(C(=O)O1)C)c1cccc(c1)C

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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 C19H25NO3 MW 315.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25NO3/c1-6-20(14-9-7-8-13(2)12-14)15(21)19-11-10-18(5,16(22)23-19)17(19,3)4/h7-9,12H,6,10-11H2,1-5H3
InChIKey
GETLWFGYMLNIOV-UHFFFAOYSA-N
Synonyms
578000-76-7
578000767
CCN(C1=CC=CC(=C1)C)C(=O)C23CCC(C2(C)C)(C(=O)O3)C
InChI=1SC19H25NO3c1620(1497813(2)1214)15(21)19111018(516(22)2319)17(193)4h7912H61011H215H3
MFCD03861485
NETHYL177TRIMETHYLN(3METHYLPHENYL)2OXO3OXABICYCLO(221)HEPTANE4CARBOXAMIDE
Nethyl477trimethyl3oxoN(mtolyl)2oxabicyclo(221)heptane1carboxamide
Nethyl477trimethylN(3methylphenyl)3oxo2oxabicyclo(221)heptane1carboxamide
NETHYLN(3METHYLPHENYL)(477TRIMETHYL3OXO2OXABICYCLO(221)HEPTYL)CARBOXAMIDE
ZINC000000352781

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Available files

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