Vitas-M small molecule compound

3-{[2-(3,4-diethoxyphenyl)ethyl]amino}-2-pentanoylcyclohex-2-en-1-one

Catalog ID
STK683314
SMILES CCCCC(=O)C1=C(CCCC1=O)NCCc1ccc(c(c1)OCC)OCC

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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 C23H33NO4 MW 387.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H33NO4/c1-4-7-10-19(25)23-18(9-8-11-20(23)26)24-15-14-17-12-13-21(27-5-2)22(16-17)28-6-3/h12-13,16,24H,4-11,14-15H2,1-3H3
InChIKey
WNJCVXZNXKIXDD-UHFFFAOYSA-N
Synonyms
3((2(34diethoxyphenyl)ethyl)amino)2pentanoylcyclohex2en1one
3(2(34DIETHOXYPHENYL)ETHYLAMINO)2PENTANOYLCYCLOHEX2EN1ONE
CCCCC(=O)C1=C(CCCC1=O)NCCC2=CC(=C(C=C2)OCC)OCC
Registry IDs
MFCD05257346
ZINC000100157048
ZINC100157048

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Available files

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