Vitas-M small molecule compound

2-(5,6,7,8-tetrahydronaphthalen-1-ylcarbamoyl)cyclohexanecarboxylic acid

Catalog ID
STK665163
SMILES O=C(C1CCCCC1C(=O)O)Nc1cccc2c1CCCC2

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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 C18H23NO3 MW 301.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23NO3/c20-17(14-9-3-4-10-15(14)18(21)22)19-16-11-5-7-12-6-1-2-8-13(12)16/h5,7,11,14-15H,1-4,6,8-10H2,(H,19,20)(H,21,22)
InChIKey
WBBPHNRIFMXEQZ-UHFFFAOYSA-N
Synonyms

2(5678tetrahydronaphthalen1ylcarbamoyl)cyclohexane1carboxylicacid
2(5678tetrahydronaphthalen1ylcarbamoyl)cyclohexanecarboxylicacid
C1CCC(C(C1)C(=O)NC2=CC=CC3=C2CCCC3)C(=O)O
InChI=1SC18H23NO3c2017(149341015(14)18(21)22)1916115712612813(12)16h57111415H146810H2(H1920)(H2122)
MFCD08142271
ZINC000006668203
ZINC000006668206

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Available files

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