Vitas-M small molecule compound

methyl 7-(2-chlorophenyl)-4-(4-hydroxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK403131
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)OC)O)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 C25H24ClNO5 MW 453.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClNO5/c1-13-22(25(30)32-3)23(14-8-9-19(28)21(12-14)31-2)24-18(27-13)10-15(11-20(24)29)16-6-4-5-7-17(16)26/h4-9,12,15,23,27-28H,10-11H2,1-3H3
InChIKey
ZZWKKSVZNFCQST-UHFFFAOYSA-N
Synonyms

CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3Cl)C4=CC(=C(C=C4)O)OC)C(=O)OC
InChI=1SC25H24ClNO5c11322(25(30)323)23(148919(28)21(1214)312)2418(2713)1015(1120(24)29)16645717(16)26h491215232728H1011H213H3
methyl7(2chlorophenyl)4(4hydroxy3methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl7(2chlorophenyl)4(4hydroxy3methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD03146575
ZINC000001155821
ZINC000001155824

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Available files

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