Vitas-M small molecule compound
ethyl 4-(3-bromo-4-methoxyphenyl)-2-ethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK371847
SMILES CCOC(=O)C1=C(CC)NC2=C(C1c1ccc(c(c1)Br)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 C21H24BrNO4 MW 434.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24BrNO4/c1-4-14-20(21(25)27-5-2)18(12-9-10-17(26-3)13(22)11-12)19-15(23-14)7-6-8-16(19)24/h9-11,18,23H,4-8H2,1-3H3InChIKey
QZGOXYZDLRDGDS-UHFFFAOYSA-NSynonyms
CCC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3)OC)Br)C(=O)OCC
ethyl4(3bromo4methoxyphenyl)2ethyl5oxo145678hexahydroquinoline3carboxylate
ethyl4(3bromo4methoxyphenyl)2ethyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC21H24BrNO4c141420(21(25)2752)18(1291017(263)13(22)1112)1915(2314)76816(19)24h9111823H48H213H3
MFCD00619537
ZINC000019287939
ZINC000019287943
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