Vitas-M small molecule compound
2-phenylethyl 4-(5-bromo-2-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK060755
SMILES COc1ccc(cc1C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCCc1ccccc1)Br
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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 C26H26BrNO4 MW 496.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26BrNO4/c1-16-23(26(30)32-14-13-17-7-4-3-5-8-17)24(19-15-18(27)11-12-22(19)31-2)25-20(28-16)9-6-10-21(25)29/h3-5,7-8,11-12,15,24,28H,6,9-10,13-14H2,1-2H3InChIKey
ZINKTPLZHCGHAU-UHFFFAOYSA-NSynonyms
2phenylethyl4(5bromo2methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2phenylethyl4(5bromo2methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CCCC2=O)C3=C(C=CC(=C3)Br)OC)C(=O)OCCC4=CC=CC=C4
COc1ccc(cc1C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCCc1ccccc1)Br
InChI=1SC26H26BrNO4c11623(26(30)321413177435817)24(191518(27)111222(19)312)2520(2816)961021(25)29h35781112152428H69101314H212H3
MFCD02104414
STK060755
ZINC000019774890
ZINC000019774892
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