Vitas-M small molecule compound
benzyl 4-(4-bromophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK364295
SMILES Brc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCc1ccccc1
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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 C24H22BrNO3 MW 452.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22BrNO3/c1-15-21(24(28)29-14-16-6-3-2-4-7-16)22(17-10-12-18(25)13-11-17)23-19(26-15)8-5-9-20(23)27/h2-4,6-7,10-13,22,26H,5,8-9,14H2,1H3InChIKey
KREMLXQVHFVPGY-UHFFFAOYSA-NSynonyms
benzyl4(4bromophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
benzyl4(4bromophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)Br)C(=O)OCC4=CC=CC=C4
InChI=1SC24H22BrNO3c11521(24(28)2914166324716)22(17101218(25)131117)2319(2615)85920(23)27h246710132226H58914H21H3
MFCD00771209
ZINC000003098475
ZINC000003098476
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