Vitas-M small molecule compound

3-[(4-benzylpiperidin-1-yl)carbonyl]bicyclo[2.2.1]heptane-2-carboxylic acid

Catalog ID
STK480035
SMILES OC(=O)C1C2CCC(C1C(=O)N1CCC(CC1)Cc1ccccc1)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 C21H27NO3 MW 341.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27NO3/c23-20(18-16-6-7-17(13-16)19(18)21(24)25)22-10-8-15(9-11-22)12-14-4-2-1-3-5-14/h1-5,15-19H,6-13H2,(H,24,25)
InChIKey
KCSHSAGRKWPIRW-UHFFFAOYSA-N
Synonyms

2(4benzylpiperidine1carbonyl)bicyclo(221)heptane3carboxylicacid
3((4benzylpiperidin1yl)carbonyl)bicyclo(221)heptane2carboxylicacid
3((4BENZYLPIPERIDYL)CARBONYL)BICYCLO(221)HEPTANE2CARBOXYLICACID
C1CC2CC1C(C2C(=O)O)C(=O)N3CCC(CC3)CC4=CC=CC=C4
InChI=1SC21H27NO3c2320(18166717(1316)19(18)21(24)25)2210815(91122)12144213514h151519H613H2(H2425)
MFCD06066310
ZINC000102361505
ZINC000239125208

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Available files

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