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3-[(2-keto-8-methoxy-6-nitro-chromene-3-carbonyl)amino]-3-(4-methoxyphenyl)propionic acid ethyl ester
SpectraBase Compound ID 9jjUFSyazuF
InChI InChI=1S/C23H22N2O9/c1-4-33-20(26)12-18(13-5-7-16(31-2)8-6-13)24-22(27)17-10-14-9-15(25(29)30)11-19(32-3)21(14)34-23(17)28/h5-11,18H,4,12H2,1-3H3,(H,24,27)
InChIKey RYCNGQHLVOJQQY-UHFFFAOYSA-N
Mol Weight 470.43 g/mol
Molecular Formula C23H22N2O9
Exact Mass 470.13253 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GttVNgQS2PJ
Name 3-[(2-keto-8-methoxy-6-nitro-chromene-3-carbonyl)amino]-3-(4-methoxyphenyl)propionic acid ethyl ester
Alternate Name(s) 3-[[(8-methoxy-6-nitro-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]-3-(4-methoxyphenyl)propanoic acid ethyl ester Ethyl 3-[(8-methoxy-6-nitro-2-oxidanylidene-chromen-3-yl)carbonylamino]-3-(4-methoxyphenyl)propanoate Ethyl 3-[(8-methoxy-6-nitro-2-oxo-chromene-3-carbonyl)amino]-3-(4-methoxyphenyl)propanoate Ethyl 3-{[(8-methoxy-6-nitro-2-oxo-2H-chromen-3-yl)carbonyl]amino}-3-(4-methoxyphenyl)propanoate
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Formula C23H22N2O9
InChI InChI=1S/C23H22N2O9/c1-4-33-20(26)12-18(13-5-7-16(31-2)8-6-13)24-22(27)17-10-14-9-15(25(29)30)11-19(32-3)21(14)34-23(17)28/h5-11,18H,4,12H2,1-3H3,(H,24,27)
InChIKey RYCNGQHLVOJQQY-UHFFFAOYSA-N
Molecular Weight 470.434 g/mol
SMILES N(C(C=1C(Oc2c(C1)cc(N(=O)=O)cc2OC)=O)=O)C(CC(=O)OCC)c1ccc(cc1)OC
SPLASH splash10-00e9-5790000000-4533051202cea3efb45e
Wiley ID 1443409