Vitas-M small molecule compound

3-[(2-methylpiperidin-1-yl)carbonyl]bicyclo[2.2.2]oct-5-ene-2-carboxylic acid

Catalog ID
STK454778
SMILES CC1CCCCN1C(=O)C1C2CCC(C1C(=O)O)C=C2

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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 C16H23NO3 MW 277.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23NO3/c1-10-4-2-3-9-17(10)15(18)13-11-5-7-12(8-6-11)14(13)16(19)20/h5,7,10-14H,2-4,6,8-9H2,1H3,(H,19,20)
InChIKey
GIGGCSDKOROSIM-UHFFFAOYSA-N
Synonyms

2(2methylpiperidine1carbonyl)bicyclo(222)oct5ene3carboxylicacid
3((2methylpiperidin1yl)carbonyl)bicyclo(222)oct5ene2carboxylicacid
3((2METHYLPIPERIDYL)CARBONYL)BICYCLO(222)OCT5ENE2CARBOXYLICACID
CC1CCCCN1C(=O)C2C3CCC(C2C(=O)O)C=C3
InChI=1SC16H23NO3c110423917(10)15(18)13115712(8611)14(13)16(19)20h571014H24689H21H3(H1920)
MFCD04228287
ZINC000102308966
ZINC000239306031

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Available files

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