Vitas-M small molecule compound
methyl 4-[4-(acetyloxy)phenyl]-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK402285
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)OC(=O)C)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 C20H21NO5 MW 355.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO5/c1-11-17(20(24)25-3)18(19-15(21-11)5-4-6-16(19)23)13-7-9-14(10-8-13)26-12(2)22/h7-10,18,21H,4-6H2,1-3H3InChIKey
XKXDNPJVRDCWPK-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)OC(=O)C)C(=O)OC
InChI=1SC20H21NO5c11117(20(24)253)18(1915(2111)54616(19)23)137914(10813)2612(2)22h7101821H46H213H3
methyl4(4(acetyloxy)phenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl4(4acetyloxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD00753239
ZINC000019638292
ZINC000019638297
Check stock
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Check stock on Vitas-MAvailable files
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