methyl 4-[[[3-(1-phenylpropan-2-yl)oxadiazol-3-ium-5-yl]carbamoylamino]methyl]benzoate,chloride structure
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Common Name | methyl 4-[[[3-(1-phenylpropan-2-yl)oxadiazol-3-ium-5-yl]carbamoylamino]methyl]benzoate,chloride | ||
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| CAS Number | 78915-47-6 | Molecular Weight | 430.88500 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C21H23ClN4O4 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | methyl 4-[[[3-(1-phenylpropan-2-yl)oxadiazol-3-ium-5-yl]carbamoylamino]methyl]benzoate,chloride |
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| Molecular Formula | C21H23ClN4O4 |
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| Molecular Weight | 430.88500 |
| Exact Mass | 430.14100 |
| PSA | 89.85000 |
| LogP | 5.26890 |
| InChIKey | KFBWDUGTINRTBE-UHFFFAOYSA-N |
| SMILES | COC(=O)c1ccc(CNC(=O)Nc2c[n+](C(C)Cc3ccccc3)no2)cc1.[Cl-] |