Vitas-M small molecule compound
butyl 4-(3-ethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK014614
SMILES CCCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)OCC)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 C23H29NO4 MW 383.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29NO4/c1-4-6-13-28-23(26)20-15(3)24-18-11-8-12-19(25)22(18)21(20)16-9-7-10-17(14-16)27-5-2/h7,9-10,14,21,24H,4-6,8,11-13H2,1-3H3InChIKey
VXNXBGUEASKBOW-UHFFFAOYSA-NSynonyms
butyl4(3ethoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
butyl4(3ethoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CCCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)OCC)C(=O)CCC2
CCCCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)OCC)C(=O)CCC2)C
InChI=1SC23H29NO4c146132823(26)2015(3)24181181219(25)22(18)21(20)16971017(1416)2752h7910142124H4681113H213H3
MFCD02188009
STK014614
ZINC000002775950
ZINC000002775951
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