Vitas-M small molecule compound
propyl 4-(6-chloro-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363787
SMILES CCCOC(=O)C1=C(C)NC2=C(C1c1cc3OCOc3cc1Cl)C(=O)CC(C2)c1ccccc1
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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 C27H26ClNO5 MW 479.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClNO5/c1-3-9-32-27(31)24-15(2)29-20-10-17(16-7-5-4-6-8-16)11-21(30)26(20)25(24)18-12-22-23(13-19(18)28)34-14-33-22/h4-8,12-13,17,25,29H,3,9-11,14H2,1-2H3InChIKey
QVUWQZMXUFMLOL-UHFFFAOYSA-NSynonyms
CCCOC(=O)C1=C(NC2=C(C1C3=CC4=C(C=C3Cl)OCO4)C(=O)CC(C2)C5=CC=CC=C5)C
InChI=1SC27H26ClNO5c1393227(31)2415(2)29201017(167546816)1121(30)26(20)25(24)18122223(1319(18)28)34143322h481213172529H391114H212H3
MFCD00771353
propyl4(6chloro13benzodioxol5yl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
propyl4(6chloro13benzodioxol5yl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
ZINC000002757639
ZINC000002757642
Check stock
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Check stock on Vitas-MAvailable files
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