Vitas-M small molecule compound
methyl 7-(2-chlorophenyl)-2-methyl-5-oxo-4-(4-oxo-4H-chromen-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK403399
SMILES COC(=O)C1=C(C)NC2=C(C1c1coc3c(c1=O)cccc3)C(=O)CC(C2)c1ccccc1Cl
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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 C27H22ClNO5 MW 475.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22ClNO5/c1-14-23(27(32)33-2)24(18-13-34-22-10-6-4-8-17(22)26(18)31)25-20(29-14)11-15(12-21(25)30)16-7-3-5-9-19(16)28/h3-10,13,15,24,29H,11-12H2,1-2H3InChIKey
UUZBQRVBMPCNQV-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3Cl)C4=COC5=CC=CC=C5C4=O)C(=O)OC
InChI=1SC27H22ClNO5c11423(27(32)332)24(181334221064817(22)26(18)31)2520(2914)1115(1221(25)30)16735919(16)28h31013152429H1112H212H3
methyl7(2chlorophenyl)2methyl5oxo4(4oxo4Hchromen3yl)145678hexahydroquinoline3carboxylate
methyl7(2chlorophenyl)2methyl5oxo4(4oxochromen3yl)4678tetrahydro1Hquinoline3carboxylate
MFCD03489225
ZINC000001077189
ZINC000001077202
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