Vitas-M small molecule compound
2-ethoxyethyl 4-(6-chloro-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK006682
SMILES CCOCCOC(=O)C1=C(C)NC2=C(C1c1cc3OCOc3cc1Cl)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 C22H24ClNO6 MW 433.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClNO6/c1-3-27-7-8-28-22(26)19-12(2)24-15-5-4-6-16(25)21(15)20(19)13-9-17-18(10-14(13)23)30-11-29-17/h9-10,20,24H,3-8,11H2,1-2H3InChIKey
WXHKPNXFGUTCAE-UHFFFAOYSA-NSynonyms
2ethoxyethyl4(6chloro13benzodioxol5yl)2methyl5oxo145678hexahydroquinoline3carboxylate
2ethoxyethyl4(6chloro13benzodioxol5yl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CCOCCOC(=O)C1=C(C)NC2=C(C1c1cc3OCOc3cc1Cl)C(=O)CCC2
CCOCCOC(=O)C1=C(NC2=C(C1C3=CC4=C(C=C3Cl)OCO4)C(=O)CCC2)C
InChI=1SC22H24ClNO6c1327782822(26)1912(2)241554616(25)21(15)20(19)1391718(1014(13)23)30112917h9102024H3811H212H3
MFCD02188074
STK006682
ZINC000002775968
ZINC000002775969
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