Vitas-M small molecule compound
2-methylpropyl 7-(4-chlorophenyl)-4-(4-hydroxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK027483
SMILES CC(COC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)O)C(=O)CC(C2)c1ccc(cc1)Cl)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 C27H28ClNO4 MW 465.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28ClNO4/c1-15(2)14-33-27(32)24-16(3)29-22-12-19(17-4-8-20(28)9-5-17)13-23(31)26(22)25(24)18-6-10-21(30)11-7-18/h4-11,15,19,25,29-30H,12-14H2,1-3H3InChIKey
LRZACYOTAGWCQB-UHFFFAOYSA-NSynonyms
2methylpropyl7(4chlorophenyl)4(4hydroxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2methylpropyl7(4chlorophenyl)4(4hydroxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC(COC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)O)C(=O)CC(C2)c1ccc(cc1)Cl)C
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)O)C(=O)OCC(C)C
InChI=1SC27H28ClNO4c115(2)143327(32)2416(3)29221219(174820(28)9517)1323(31)26(22)25(24)1861021(30)11718h4111519252930H1214H213H3
MFCD01873714
STK027483
ZINC000001203703
ZINC000001203715
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