Vitas-M small molecule compound
2-methoxyethyl 4-(2,3-dichlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363427
SMILES COCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1Cl)Cl)C(=O)CCC2
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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 C20H21Cl2NO4 MW 410.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21Cl2NO4/c1-11-16(20(25)27-10-9-26-2)17(12-5-3-6-13(21)19(12)22)18-14(23-11)7-4-8-15(18)24/h3,5-6,17,23H,4,7-10H2,1-2H3InChIKey
XNXYLFXHFDUXNG-UHFFFAOYSA-NSynonyms
2methoxyethyl4(23dichlorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2methoxyethyl4(23dichlorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CCCC2=O)C3=C(C(=CC=C3)Cl)Cl)C(=O)OCCOC
InChI=1SC20H21Cl2NO4c11116(20(25)27109262)17(1253613(21)19(12)22)1814(2311)74815(18)24h3561723H4710H212H3
MFCD00752992
ZINC000002055133
ZINC000002055134
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