Vitas-M small molecule compound
2-phenoxyethyl 7-(4-chlorophenyl)-4-(2-ethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363646
SMILES CCOc1ccccc1C1C(=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 C33H32ClNO5 MW 558.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H32ClNO5/c1-3-38-29-12-8-7-11-26(29)31-30(33(37)40-18-17-39-25-9-5-4-6-10-25)21(2)35-27-19-23(20-28(36)32(27)31)22-13-15-24(34)16-14-22/h4-16,23,31,35H,3,17-20H2,1-2H3InChIKey
ZIAPDLGHZNSKQI-UHFFFAOYSA-NSynonyms
2phenoxyethyl7(4chlorophenyl)4(2ethoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2phenoxyethyl7(4chlorophenyl)4(2ethoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CCOC1=CC=CC=C1C2C3=C(CC(CC3=O)C4=CC=C(C=C4)Cl)NC(=C2C(=O)OCCOC5=CC=CC=C5)C
InChI=1SC33H32ClNO5c13382912871126(29)3130(33(37)401817392595461025)21(2)35271923(2028(36)32(27)31)22131524(34)161422h416233135H31720H212H3
MFCD01471065
ZINC000100554304
ZINC000100554312
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