2-Furanpropionic acid, alpha-(1-naphthylmethyl)-, 4-(diethylamino)butyl ester, oxalate (1:1)
diethyl-[4-[2-(furan-2-ylmethyl)-3-naphthalen-1-ylpropanoyl]oxybutyl]azanium;2-hydroxy-2-oxoacetate
| Molecular Formula | C28H35NO7 |
|---|---|
| Molecular Weight | 497.6 g/mol |
| Topological Polar Surface Area | 121.0 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 13 |
| Exact Mass | 497.24136 |
| Heavy Atoms | 36 |
| Complexity | 571.0 |
Chemical Identifiers
| CAS Number | 3406-50-6 |
|---|---|
| SMILES | CC[NH+](CC)CCCCOC(=O)C(CC1=CC=CC2=CC=CC=C21)CC3=CC=CO3.C(=O)(C(=O)[O-])O |
| InChIKey | HUFZSVUNGXWTBY-UHFFFAOYSA-N |
📖 Product Overview
2-Furanpropionic acid, alpha-(1-naphthylmethyl)-, 4-(diethylamino)butyl ester, oxalate (1:1) (CAS: 3406-50-6) is a chemical compound with molecular formula C28H35NO7 and molecular weight 497.6 g/mol. Its IUPAC systematic name is diethyl-[4-[2-(furan-2-ylmethyl)-3-naphthalen-1-ylpropanoyl]oxybutyl]azanium;2-hydroxy-2-oxoacetate.
HUFZSVUNGXWTBY-UHFFFAOYSA-N.
SMILES: CC[NH+](CC)CCCCOC(=O)C(CC1=CC=CC2=CC=CC=C21)CC3=CC=CO3.C(=O)(C(=O)[O-])O.
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