Vitas-M small molecule compound
cyclohexyl 4-(4-bromophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK019036
SMILES Brc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OC1CCCCC1
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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 C23H26BrNO3 MW 444.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26BrNO3/c1-14-20(23(27)28-17-6-3-2-4-7-17)21(15-10-12-16(24)13-11-15)22-18(25-14)8-5-9-19(22)26/h10-13,17,21,25H,2-9H2,1H3InChIKey
ITJXPPUKBJZXDH-UHFFFAOYSA-NSynonyms
Brc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OC1CCCCC1
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)Br)C(=O)OC4CCCCC4
cyclohexyl4(4bromophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
cyclohexyl4(4bromophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC23H26BrNO3c11420(23(27)28176324717)21(15101216(24)131115)2218(2514)85919(22)26h1013172125H29H21H3
MFCD00771177
STK019036
ZINC000019639968
ZINC000019639975
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