Vitas-M small molecule compound
2-ethoxyethyl 4-(2,4-dichlorophenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK031097
SMILES CCOCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1Cl)Cl)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 C27H27Cl2NO4 MW 500.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27Cl2NO4/c1-3-33-11-12-34-27(32)24-16(2)30-22-13-18(17-7-5-4-6-8-17)14-23(31)26(22)25(24)20-10-9-19(28)15-21(20)29/h4-10,15,18,25,30H,3,11-14H2,1-2H3InChIKey
YRQUUYHOXSNCGC-UHFFFAOYSA-NSynonyms
312597-10-72ethoxyethyl4(24dichlorophenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
2ethoxyethyl4(24dichlorophenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
312597107
CCOCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1Cl)Cl)C(=O)CC(C2)c1ccccc1
CCOCCOC(=O)C1=C(NC2=C(C1C3=C(C=C(C=C3)Cl)Cl)C(=O)CC(C2)C4=CC=CC=C4)C
InChI=1SC27H27Cl2NO4c133311123427(32)2416(2)30221318(177546817)1423(31)26(22)25(24)2010919(28)1521(20)29h41015182530H31114H212H3
MFCD01824416
STK031097
ZINC000002757491
ZINC000002757494
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