Vitas-M small molecule compound
2-phenoxyethyl 4-(3,4-dichlorophenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK067624
SMILES COc1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1ccc(c(c1)Cl)Cl)C(=O)OCCOc1ccccc1)C
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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 C32H29Cl2NO5 MW 578.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29Cl2NO5/c1-19-29(32(37)40-15-14-39-24-6-4-3-5-7-24)30(21-10-13-25(33)26(34)16-21)31-27(35-19)17-22(18-28(31)36)20-8-11-23(38-2)12-9-20/h3-13,16,22,30,35H,14-15,17-18H2,1-2H3InChIKey
LJLUPPHKPCITIX-UHFFFAOYSA-NSynonyms
312587-23-82phenoxyethyl4(34dichlorophenyl)7(4methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2phenoxyethyl4(34dichlorophenyl)7(4methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
312587238
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)OC)C4=CC(=C(C=C4)Cl)Cl)C(=O)OCCOC5=CC=CC=C5
COc1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1ccc(c(c1)Cl)Cl)C(=O)OCCOc1ccccc1)C
InChI=1SC32H29Cl2NO5c11929(32(37)40151439246435724)30(21101325(33)26(34)1621)3127(3519)1722(1828(31)36)2081123(382)12920h31316223035H14151718H212H3
MFCD01823925
STK067624
ZINC000059706463
ZINC000059706471
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