Vitas-M small molecule compound

methyl [(4-cyano-1-cyclohexyl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-yl)oxy]acetate

Catalog ID
STK659069
SMILES COC(=O)COc1nc(C2CCCCC2)c2c(c1C#N)CCC2

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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 C18H22N2O3 MW 314.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O3/c1-22-16(21)11-23-18-15(10-19)13-8-5-9-14(13)17(20-18)12-6-3-2-4-7-12/h12H,2-9,11H2,1H3
InChIKey
XZIXMBDBMLVKAP-UHFFFAOYSA-N
Synonyms
1144456-73-4
1144456734
COC(=O)COC1=NC(=C2CCCC2=C1C#N)C3CCCCC3
InChI=1SC18H22N2O3c12216(21)11231815(1019)1385914(13)17(2018)126324712h12H2911H21H3
methyl((4cyano1cyclohexyl67dihydro5Hcyclopenta(c)pyridin3yl)oxy)acetate
methyl2((4cyano1cyclohexyl67dihydro5Hcyclopenta(c)pyridin3yl)oxy)acetate
MFCD12213985
ZINC000032092552
ZINC32092552

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Available files

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