Vitas-M small molecule compound
ethyl 4-(3-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK096058
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)F)C(=O)CC(C2)(C)C
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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 C21H24FNO3 MW 357.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24FNO3/c1-5-26-20(25)17-12(2)23-15-10-21(3,4)11-16(24)19(15)18(17)13-7-6-8-14(22)9-13/h6-9,18,23H,5,10-11H2,1-4H3InChIKey
KBXZHDKWLJGXJY-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)F)C(=O)CC(C2)(C)C
CCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)F)C(=O)CC(C2)(C)C)C
ethyl4(3fluorophenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
ethyl4(3fluorophenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
InChI=1SC21H24FNO3c152620(25)1712(2)23151021(34)1116(24)19(15)18(17)1376814(22)913h691823H51011H214H3
MFCD00371494
STK096058
ZINC000019314471
ZINC000019314474
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