Vitas-M small molecule compound
methyl 4-(1,3-benzodioxol-5-yl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372227
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccc3c(c1)OCO3)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 C25H23NO5 MW 417.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23NO5/c1-14-22(25(28)29-2)23(16-8-9-20-21(12-16)31-13-30-20)24-18(26-14)10-17(11-19(24)27)15-6-4-3-5-7-15/h3-9,12,17,23,26H,10-11,13H2,1-2H3InChIKey
JHGDVEJWBIFNBE-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC5=C(C=C4)OCO5)C(=O)OC
InChI=1SC25H23NO5c11422(25(28)292)23(16892021(1216)31133020)2418(2614)1017(1119(24)27)156435715h3912172326H101113H212H3
methyl4(13benzodioxol5yl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
methyl4(13benzodioxol5yl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
MFCD00614966
ZINC000019313841
ZINC000019313851
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Check stock on Vitas-MAvailable files
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