Vitas-M small molecule compound
2-ethoxyethyl 7-(4-chlorophenyl)-4-(3-hydroxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK042378
SMILES CCOCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)O)C(=O)CC(C2)c1ccc(cc1)Cl
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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 C27H28ClNO5 MW 481.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28ClNO5/c1-3-33-11-12-34-27(32)24-16(2)29-22-14-19(17-7-9-20(28)10-8-17)15-23(31)26(22)25(24)18-5-4-6-21(30)13-18/h4-10,13,19,25,29-30H,3,11-12,14-15H2,1-2H3InChIKey
NMVWMVXAUXIVCO-UHFFFAOYSA-NSynonyms
2ethoxyethyl7(4chlorophenyl)4(3hydroxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2ethoxyethyl7(4chlorophenyl)4(3hydroxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CCOCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)O)C(=O)CC(C2)c1ccc(cc1)Cl
CCOCCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)O)C(=O)CC(C2)C4=CC=C(C=C4)Cl)C
InChI=1SC27H28ClNO5c133311123427(32)2416(2)29221419(177920(28)10817)1523(31)26(22)25(24)1854621(30)1318h4101319252930H311121415H212H3
MFCD02632916
STK042378
ZINC000002788635
ZINC000013165853
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