Vitas-M small molecule compound
cyclohexyl 2,7,7-trimethyl-5-oxo-4-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372488
SMILES O=C(C1=C(C)NC2=C(C1c1ccccc1C(F)(F)F)C(=O)CC(C2)(C)C)OC1CCCCC1
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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 C26H30F3NO3 MW 461.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30F3NO3/c1-15-21(24(32)33-16-9-5-4-6-10-16)22(17-11-7-8-12-18(17)26(27,28)29)23-19(30-15)13-25(2,3)14-20(23)31/h7-8,11-12,16,22,30H,4-6,9-10,13-14H2,1-3H3InChIKey
PVFDSUPRYPHUDW-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=CC=C3C(F)(F)F)C(=O)OC4CCCCC4
cyclohexyl277trimethyl5oxo4(2(trifluoromethyl)phenyl)145678hexahydroquinoline3carboxylate
cyclohexyl277trimethyl5oxo4(2(trifluoromethyl)phenyl)1468tetrahydroquinoline3carboxylate
InChI=1SC26H30F3NO3c11521(24(32)331695461016)22(1711781218(17)26(2728)29)2319(3015)1325(23)1420(23)31h781112162230H469101314H213H3
MFCD00717884
ZINC000002069348
ZINC000002069349
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Check stock on Vitas-MAvailable files
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