Vitas-M small molecule compound
2-ethoxyethyl 4-(3-fluorophenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK000429
SMILES CCOCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)F)C(=O)CC(C2)c1ccccc1
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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 C27H28FNO4 MW 449.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28FNO4/c1-3-32-12-13-33-27(31)24-17(2)29-22-15-20(18-8-5-4-6-9-18)16-23(30)26(22)25(24)19-10-7-11-21(28)14-19/h4-11,14,20,25,29H,3,12-13,15-16H2,1-2H3InChIKey
MWUHPVUASZZKHS-UHFFFAOYSA-NSynonyms
2ethoxyethyl4(3fluorophenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
2ethoxyethyl4(3fluorophenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
CCOCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)F)C(=O)CC(C2)c1ccccc1
CCOCCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)F)C(=O)CC(C2)C4=CC=CC=C4)C
InChI=1SC27H28FNO4c133212133327(31)2417(2)29221520(188546918)1623(30)26(22)25(24)191071121(28)1419h41114202529H312131516H212H3
MFCD02375934
STK000429
ZINC000002775331
ZINC000002775334
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