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3-[(2-keto-8-methoxy-6-nitro-chromene-3-carbonyl)amino]-3-(3-nitrophenyl)propionic acid ethyl ester
SpectraBase Compound ID CNfsZFbYZft
InChI InChI=1S/C22H19N3O10/c1-3-34-19(26)11-17(12-5-4-6-14(7-12)24(29)30)23-21(27)16-9-13-8-15(25(31)32)10-18(33-2)20(13)35-22(16)28/h4-10,17H,3,11H2,1-2H3,(H,23,27)
InChIKey OIIZMUAIVUKMBT-UHFFFAOYSA-N
Mol Weight 485.41 g/mol
Molecular Formula C22H19N3O10
Exact Mass 485.107044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2TOJcmkTnU
Name 3-[(2-keto-8-methoxy-6-nitro-chromene-3-carbonyl)amino]-3-(3-nitrophenyl)propionic acid ethyl ester
Alternate Name(s) 3-[[(8-methoxy-6-nitro-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]-3-(3-nitrophenyl)propanoic acid ethyl ester Ethyl 3-[(8-methoxy-6-nitro-2-oxidanylidene-chromen-3-yl)carbonylamino]-3-(3-nitrophenyl)propanoate Ethyl 3-[(8-methoxy-6-nitro-2-oxo-chromene-3-carbonyl)amino]-3-(3-nitrophenyl)propanoate Ethyl 3-{[(8-methoxy-6-nitro-2-oxo-2H-chromen-3-yl)carbonyl]amino}-3-(3-nitrophenyl)propanoate
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Formula C22H19N3O10
InChI InChI=1S/C22H19N3O10/c1-3-34-19(26)11-17(12-5-4-6-14(7-12)24(29)30)23-21(27)16-9-13-8-15(25(31)32)10-18(33-2)20(13)35-22(16)28/h4-10,17H,3,11H2,1-2H3,(H,23,27)
InChIKey OIIZMUAIVUKMBT-UHFFFAOYSA-N
Molecular Weight 485.405 g/mol
SMILES N(C(C=1C(Oc2c(C1)cc(N(=O)=O)cc2OC)=O)=O)C(CC(=O)OCC)c1cc(N(=O)=O)ccc1
SPLASH splash10-000e-8690000000-c4d02bd2c1bf5a68dd77
Wiley ID 1443444