Vitas-M small molecule compound
ethyl 4-(2-ethoxyphenyl)-2-ethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363159
SMILES CCOC(=O)C1=C(CC)NC2=C(C1c1ccccc1OCC)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 C22H27NO4 MW 369.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO4/c1-4-15-21(22(25)27-6-3)19(14-10-7-8-13-18(14)26-5-2)20-16(23-15)11-9-12-17(20)24/h7-8,10,13,19,23H,4-6,9,11-12H2,1-3H3InChIKey
ORNMNLFIPDEZDH-UHFFFAOYSA-NSynonyms
CCC1=C(C(C2=C(N1)CCCC2=O)C3=CC=CC=C3OCC)C(=O)OCC
ethyl4(2ethoxyphenyl)2ethyl5oxo145678hexahydroquinoline3carboxylate
ethyl4(2ethoxyphenyl)2ethyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC22H27NO4c141521(22(25)2763)19(1410781318(14)2652)2016(2315)1191217(20)24h7810131923H4691112H213H3
MFCD00656118
ZINC000019638502
ZINC000019638508
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