Vitas-M small molecule compound
ethyl 2-methyl-5-oxo-7-phenyl-4-(2-propoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK099147
SMILES CCCOc1ccccc1C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccccc1)C(=O)OCC
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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 C28H31NO4 MW 445.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31NO4/c1-4-15-33-24-14-10-9-13-21(24)26-25(28(31)32-5-2)18(3)29-22-16-20(17-23(30)27(22)26)19-11-7-6-8-12-19/h6-14,20,26,29H,4-5,15-17H2,1-3H3InChIKey
MQCRGRCXXRGJAF-UHFFFAOYSA-NSynonyms
299454-12-9299454129
CCCOC1=CC=CC=C1C2C3=C(CC(CC3=O)C4=CC=CC=C4)NC(=C2C(=O)OCC)C
CCCOc1ccccc1C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccccc1)C(=O)OCC
ethyl2methyl5oxo7phenyl4(2propoxyphenyl)145678hexahydroquinoline3carboxylate
ethyl2methyl5oxo7phenyl4(2propoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
InChI=1SC28H31NO4c14153324141091321(24)2625(28(31)3252)18(3)29221620(1723(30)27(22)26)19117681219h614202629H451517H213H3
MFCD00614925
STK099147
ZINC000004064661
ZINC000004064668
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