Vitas-M small molecule compound
2-methoxyethyl 4,7-bis(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK055501
SMILES COCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)Cl)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 C26H25Cl2NO4 MW 486.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25Cl2NO4/c1-15-23(26(31)33-12-11-32-2)24(17-5-9-20(28)10-6-17)25-21(29-15)13-18(14-22(25)30)16-3-7-19(27)8-4-16/h3-10,18,24,29H,11-14H2,1-2H3InChIKey
DBXTTYNSLREUHE-UHFFFAOYSA-NSynonyms
2methoxyethyl47bis(4chlorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2methoxyethyl47bis(4chlorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl)C(=O)OCCOC
COCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)Cl)C(=O)CC(C2)c1ccc(cc1)Cl
InChI=1SC26H25Cl2NO4c11523(26(31)331211322)24(175920(28)10617)2521(2915)1318(1422(25)30)163719(27)8416h310182429H1114H212H3
MFCD01445684
STK055501
ZINC000002925337
ZINC000002925350
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