Vitas-M small molecule compound
ethyl 4-(3-chloro-4-ethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK407021
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)Cl)OCC)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 C21H24ClNO4 MW 389.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClNO4/c1-4-26-17-10-9-13(11-14(17)22)19-18(21(25)27-5-2)12(3)23-15-7-6-8-16(24)20(15)19/h9-11,19,23H,4-8H2,1-3H3InChIKey
IZUBCQLZCCDFGY-UHFFFAOYSA-NSynonyms
879039-72-2879039722
CCOC1=C(C=C(C=C1)C2C3=C(CCCC3=O)NC(=C2C(=O)OCC)C)Cl
ethyl4(3chloro4ethoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
ethyl4(3chloro4ethoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC21H24ClNO4c14261710913(1114(17)22)1918(21(25)2752)12(3)231576816(24)20(15)19h9111923H48H213H3
MFCD07402532
ZINC000004945338
ZINC000004945339
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