Vitas-M small molecule compound
2-methoxyethyl 4-[4-(acetyloxy)phenyl]-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK010146
SMILES COCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)OC(=O)C)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 C28H28ClNO6 MW 509.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28ClNO6/c1-16-25(28(33)35-13-12-34-3)26(19-6-10-22(11-7-19)36-17(2)31)27-23(30-16)14-20(15-24(27)32)18-4-8-21(29)9-5-18/h4-11,20,26,30H,12-15H2,1-3H3InChIKey
CZRLDLGFLNBHNE-UHFFFAOYSA-NSynonyms
2methoxyethyl4(4(acetyloxy)phenyl)7(4chlorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2methoxyethyl4(4acetyloxyphenyl)7(4chlorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OC(=O)C)C(=O)OCCOC
COCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)OC(=O)C)C(=O)CC(C2)c1ccc(cc1)Cl
InChI=1SC28H28ClNO6c11625(28(33)351312343)26(1961022(11719)3617(2)31)2723(3016)1420(1524(27)32)184821(29)9518h411202630H1215H213H3
MFCD01445645
STK010146
ZINC000002063180
ZINC000002063183
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