SpectraBase Spectrum ID |
76LSXvzL6p4 |
Name |
3-(4-Methylphenyl)-3-[[(6-nitro-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]propanoic acid ethyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H20N2O7 |
InChI |
InChI=1S/C22H20N2O7/c1-3-30-20(25)12-18(14-6-4-13(2)5-7-14)23-21(26)17-11-15-10-16(24(28)29)8-9-19(15)31-22(17)27/h4-11,18H,3,12H2,1-2H3,(H,23,26) |
InChIKey |
ZJSMMNUIPOMDBP-UHFFFAOYSA-N |
Molecular Weight |
424.409 g/mol |
SMILES |
N(C(C=1C(Oc2c(C1)cc(N(=O)=O)cc2)=O)=O)C(CC(=O)OCC)c1ccc(cc1)C |
SPLASH |
splash10-0aor-3891000000-9870ab36e77f54df4c17 |
Synonyms |
3-[(2-keto-6-nitro-chromene-3-carbonyl)amino]-3-(p-tolyl)propionic acid ethyl ester
Ethyl 3-(4-methylphenyl)-3-[(6-nitro-2-oxidanylidene-chromen-3-yl)carbonylamino]propanoate
Ethyl 3-(4-methylphenyl)-3-[(6-nitro-2-oxochromene-3-carbonyl)amino]propanoate
Ethyl 3-(4-methylphenyl)-3-{[(6-nitro-2-oxo-2H-chromen-3-yl)carbonyl]amino}propanoate
Ethyl 3-[(6-nitro-2-oxo-chromene-3-carbonyl)amino]-3-(p-tolyl)propanoate |
Wiley ID |
1443039 |