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3-[(6,8-dichloro-2-keto-chromene-3-carbonyl)amino]-3-(4-methoxyphenyl)propionic acid ethyl ester
SpectraBase Compound ID 4m7zByMpLzz
InChI InChI=1S/C22H19Cl2NO6/c1-3-30-19(26)11-18(12-4-6-15(29-2)7-5-12)25-21(27)16-9-13-8-14(23)10-17(24)20(13)31-22(16)28/h4-10,18H,3,11H2,1-2H3,(H,25,27)
InChIKey BCEPAPHWYHRFPP-UHFFFAOYSA-N
Mol Weight 464.3 g/mol
Molecular Formula C22H19Cl2NO6
Exact Mass 463.058943 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gm9Ebu8IByd
Name 3-[(6,8-dichloro-2-keto-chromene-3-carbonyl)amino]-3-(4-methoxyphenyl)propionic acid ethyl ester
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Formula C22H19Cl2NO6
InChI InChI=1S/C22H19Cl2NO6/c1-3-30-19(26)11-18(12-4-6-15(29-2)7-5-12)25-21(27)16-9-13-8-14(23)10-17(24)20(13)31-22(16)28/h4-10,18H,3,11H2,1-2H3,(H,25,27)
InChIKey BCEPAPHWYHRFPP-UHFFFAOYSA-N
Molecular Weight 464.301 g/mol
SMILES N(C(C=1C(Oc2c(C1)cc(cc2Cl)Cl)=O)=O)C(CC(=O)OCC)c1ccc(cc1)OC
SPLASH splash10-00di-4981000000-c07319691d356a2cf2d8
Synonyms 3-[[(6,8-dichloro-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]-3-(4-methoxyphenyl)propanoic acid ethyl ester Ethyl 3-[(6,8-dichloro-2-oxo-chromene-3-carbonyl)amino]-3-(4-methoxyphenyl)propanoate Ethyl 3-[[6,8-bis(chloranyl)-2-oxidanylidene-chromen-3-yl]carbonylamino]-3-(4-methoxyphenyl)propanoate Ethyl 3-{[(6,8-dichloro-2-oxo-2H-chromen-3-yl)carbonyl]amino}-3-(4-methoxyphenyl)propanoate
Wiley ID 1443411