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| IUPAC Name: | methyl 4-acetamido-2-ethoxy-5-nitrobenzoate |
| Description: | A reactant used in the preparation Cinitapride (C441990) and 6-methoxy-1H-benzotriazole-5-carboxamide derivatives with antiemetic and gastroprokinetic activities. |
| Molecular Weight: | 282.25 |
| Molecular Formula: | C12H14NO2O6 |
| Canonical SMILES: | CCOC1=CC(=C(C=C1C(=O)OC)[N+](=O)[O-])NC(=O)C |
| InChI: | InChI=1S/C12H14N2O6/c1-4-20-11-6-9(13-7(2)15)10(14(17)18)5-8(11)12(16)19-3/h5-6H,4H2,1-3H3,(H,13,15) |
| InChI Key: | ZXCSXMZHXLGCEP-UHFFFAOYSA-N |
| Solubility: | Dichloromethane, Methanol |
| Appearance: | Yellow Solid |
| Storage: | Refrigerator |
| References: | Hirokawa, Y. et al. Bioorg. Med. Chem. Lett., 8, 1973 (1998). |
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