Vitas-M small molecule compound
propyl 4-(3,4-difluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK097055
SMILES CCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)F)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 C22H25F2NO3 MW 389.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25F2NO3/c1-5-8-28-21(27)18-12(2)25-16-10-22(3,4)11-17(26)20(16)19(18)13-6-7-14(23)15(24)9-13/h6-7,9,19,25H,5,8,10-11H2,1-4H3InChIKey
HJEMXWGGIUQZOP-UHFFFAOYSA-NSynonyms
CCCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)F)F)C(=O)CC(C2)(C)C
CCCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)F)F)C(=O)CC(C2)(C)C)C
InChI=1SC22H25F2NO3c1582821(27)1812(2)25161022(34)1117(26)20(16)19(18)136714(23)15(24)913h6791925H581011H214H3
MFCD02188190
propyl4(34difluorophenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
propyl4(34difluorophenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
STK097055
ZINC000002190475
ZINC000002190476
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