Vitas-M small molecule compound
2-phenoxyethyl 4-(3,4-difluorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK378276
SMILES O=C(C1=C(C)NC2=C(C1c1ccc(c(c1)F)F)C(=O)CCC2)OCCOc1ccccc1
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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 C25H23F2NO4 MW 439.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23F2NO4/c1-15-22(25(30)32-13-12-31-17-6-3-2-4-7-17)23(16-10-11-18(26)19(27)14-16)24-20(28-15)8-5-9-21(24)29/h2-4,6-7,10-11,14,23,28H,5,8-9,12-13H2,1H3InChIKey
XCNDXXRPBKSOES-UHFFFAOYSA-NSynonyms
2phenoxyethyl4(34difluorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2phenoxyethyl4(34difluorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3)F)F)C(=O)OCCOC4=CC=CC=C4
InChI=1SC25H23F2NO4c11522(25(30)32131231176324717)23(16101118(26)19(27)1416)2420(2815)85921(24)29h24671011142328H5891213H21H3
MFCD01823645
ZINC000003670741
ZINC000003670742
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