Vitas-M small molecule compound
ethyl 2,7,7-trimethyl-4-(naphthalen-1-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372272
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1cccc3c1cccc3)C(=O)CC(C2)(C)C
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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 C25H27NO3 MW 389.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO3/c1-5-29-24(28)21-15(2)26-19-13-25(3,4)14-20(27)23(19)22(21)18-12-8-10-16-9-6-7-11-17(16)18/h6-12,22,26H,5,13-14H2,1-4H3InChIKey
HASWDZYUGLTPMB-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC2=C(C1C3=CC=CC4=CC=CC=C43)C(=O)CC(C2)(C)C)C
ethyl277trimethyl4(naphthalen1yl)5oxo145678hexahydroquinoline3carboxylate
ethyl277trimethyl4naphthalen1yl5oxo1468tetrahydroquinoline3carboxylate
InChI=1SC25H27NO3c152924(28)2115(2)26191325(34)1420(27)23(19)22(21)1812810169671117(16)18h6122226H51314H214H3
MFCD00770887
ZINC000004624835
ZINC000019791863
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