Vitas-M small molecule compound
2-phenoxyethyl 7-(4-chlorophenyl)-2-methyl-5-oxo-4-(2-propoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK402487
SMILES CCCOc1ccccc1C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccc(cc1)Cl)C(=O)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 C34H34ClNO5 MW 572.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H34ClNO5/c1-3-17-40-30-12-8-7-11-27(30)32-31(34(38)41-19-18-39-26-9-5-4-6-10-26)22(2)36-28-20-24(21-29(37)33(28)32)23-13-15-25(35)16-14-23/h4-16,24,32,36H,3,17-21H2,1-2H3InChIKey
IBBPXOSLUYBARN-UHFFFAOYSA-NSynonyms
2phenoxyethyl7(4chlorophenyl)2methyl5oxo4(2propoxyphenyl)145678hexahydroquinoline3carboxylate
2phenoxyethyl7(4chlorophenyl)2methyl5oxo4(2propoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
CCCOC1=CC=CC=C1C2C3=C(CC(CC3=O)C4=CC=C(C=C4)Cl)NC(=C2C(=O)OCCOC5=CC=CC=C5)C
InChI=1SC34H34ClNO5c1317403012871127(30)3231(34(38)411918392695461026)22(2)36282024(2129(37)33(28)32)23131525(35)161423h416243236H31721H212H3
MFCD01590168
ZINC000100559104
ZINC000100559112
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