Vitas-M small molecule compound
benzyl 4-(2-bromophenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK065819
SMILES O=C(C1=C(C)NC2=C(C1c1ccccc1Br)C(=O)CC(C2)c1ccccc1)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 C30H26BrNO3 MW 528.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26BrNO3/c1-19-27(30(34)35-18-20-10-4-2-5-11-20)28(23-14-8-9-15-24(23)31)29-25(32-19)16-22(17-26(29)33)21-12-6-3-7-13-21/h2-15,22,28,32H,16-18H2,1H3InChIKey
AACIDKCASCFPJZ-UHFFFAOYSA-NSynonyms
benzyl4(2bromophenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
benzyl4(2bromophenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC=CC=C4Br)C(=O)OCC5=CC=CC=C5
InChI=1SC30H26BrNO3c11927(30(34)351820104251120)28(2314891524(23)31)2925(3219)1622(1726(29)33)21126371321h215222832H1618H21H3
MFCD01529766
O=C(C1=C(C)NC2=C(C1c1ccccc1Br)C(=O)CC(C2)c1ccccc1)OCc1ccccc1
STK065819
ZINC000100562994
ZINC000100563003
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