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4-(3-bromo-4-hydroxy-5-methoxy-phenyl)-5-keto-7-(4-methoxyphenyl)-2-methyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid isopropyl ester
SpectraBase Compound ID BtKQU2W90W1
InChI InChI=1S/C28H30BrNO6/c1-14(2)36-28(33)24-15(3)30-21-11-17(16-6-8-19(34-4)9-7-16)12-22(31)26(21)25(24)18-10-20(29)27(32)23(13-18)35-5/h6-10,13-14,17,25,30,32H,11-12H2,1-5H3
InChIKey IMODBXUNSJNCNZ-UHFFFAOYSA-N
Mol Weight 556.45 g/mol
Molecular Formula C28H30BrNO6
Exact Mass 555.125651 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IxEYzXLQXPV
Name 4-(3-bromo-4-hydroxy-5-methoxy-phenyl)-5-keto-7-(4-methoxyphenyl)-2-methyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid isopropyl ester
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Formula C28H30BrNO6
InChI InChI=1S/C28H30BrNO6/c1-14(2)36-28(33)24-15(3)30-21-11-17(16-6-8-19(34-4)9-7-16)12-22(31)26(21)25(24)18-10-20(29)27(32)23(13-18)35-5/h6-10,13-14,17,25,30,32H,11-12H2,1-5H3
InChIKey IMODBXUNSJNCNZ-UHFFFAOYSA-N
Molecular Weight 556.453 g/mol
SMILES N1C(=C(C(c2cc(c(c(c2)Br)O)OC)C=2C(CC(CC12)c1ccc(cc1)OC)=O)C(OC(C)C)=O)C
SPLASH splash10-0zfr-2429030000-aa3e4e334b65b2d36755
Synonyms 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid propan-2-yl ester isopropyl 4-(3-bromo-4-hydroxy-5-methoxy-phenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Isopropyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate Propan-2-yl 4-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Propan-2-yl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Wiley ID 1439006