Vitas-M small molecule compound

3-ethyl 6-methyl 4-(2-chloro-6-fluorophenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate

Catalog ID
STK407446
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1c(F)cccc1Cl)C(=O)C(C(C2)C)C(=O)OC

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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 C22H23ClFNO5 MW 435.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClFNO5/c1-5-30-22(28)16-11(3)25-14-9-10(2)15(21(27)29-4)20(26)18(14)19(16)17-12(23)7-6-8-13(17)24/h6-8,10,15,19,25H,5,9H2,1-4H3
InChIKey
LCDCXQRBGZMGFG-UHFFFAOYSA-N
Synonyms

3ethyl6methyl4(2chloro6fluorophenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3Oethyl6Omethyl4(2chloro6fluorophenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCOC(=O)C1=C(NC2=C(C1C3=C(C=CC=C3Cl)F)C(=O)C(C(C2)C)C(=O)OC)C
InChI=1SC22H23ClFNO5c153022(28)1611(3)2514910(2)15(21(27)294)20(26)18(14)19(16)1712(23)76813(17)24h6810151925H59H214H3
MFCD04057095
ZINC000003631427
ZINC000033936365

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Available files

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