Vitas-M small molecule compound
ethyl 4-[4-(methoxycarbonyl)phenyl]-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363207
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)C(=O)OC)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 C21H23NO5 MW 369.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23NO5/c1-4-27-21(25)17-12(2)22-15-6-5-7-16(23)19(15)18(17)13-8-10-14(11-9-13)20(24)26-3/h8-11,18,22H,4-7H2,1-3H3InChIKey
LCXJQXMTVMBGOK-UHFFFAOYSA-NSynonyms
33323-09-033323090
CCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)C(=O)OC)C(=O)CCC2)C
ethyl4(4(methoxycarbonyl)phenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
ethyl4(4methoxycarbonylphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC21H23NO5c142721(25)1712(2)221565716(23)19(15)18(17)1381014(11913)20(24)263h8111822H47H213H3
MFCD00717939
ZINC000000626583
ZINC000000626587
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