| SpectraBase Spectrum ID |
6WM6N0X5dRi |
| Name |
2H-1-benzopyran-3-propanoic acid, 4-hydroxy-.beta.-(4-nitrophenyl)-2-oxo-, methyl ester |
| Alternate Name(s) |
Acenocoumarol methyl ester artifact 1-nominalmass 367
Acenocoumarol methyl ester artifact 2-nominalmass 367
Methyl 3-(4-hydroxy-2-oxo-2H-chromen-3-yl)-3-(4-nitrophenyl)propanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H15NO7 |
| InChI |
InChI=1S/C19H15NO7/c1-26-16(21)10-14(11-6-8-12(9-7-11)20(24)25)17-18(22)13-4-2-3-5-15(13)27-19(17)23/h2-9,14,22H,10H2,1H3 |
| InChIKey |
HTVQIHPWTYJNQZ-UHFFFAOYSA-N |
| Molecular Weight |
369.329 g/mol |
| SMILES |
OC=1c2ccccc2OC(C1C(CC(OC)=O)c1ccc(cc1)N(=O)=O)=O |
| SPLASH |
splash10-02mi-6539000000-531b3215fc3d0b8abf5f |
| Wiley ID |
1507901 |
