DTXSID40905661
5-[3-[5-[diethyl(methyl)azaniumyl]pentoxycarbonyl]-2,4-diphenylcyclobutanecarbonyl]oxypentyl-diethyl-methylazanium diiodide
| Molecular Formula | C38H60I2N2O4 |
|---|---|
| Molecular Weight | 862.7 g/mol |
| Topological Polar Surface Area | 52.6 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 22 |
| Exact Mass | 862.2642 |
| Heavy Atoms | 46 |
| Complexity | 747.0 |
Chemical Identifiers
| CAS Number | 10066-76-9 |
|---|---|
| SMILES | CC[N+](C)(CC)CCCCCOC(=O)C1C(C(C1C2=CC=CC=C2)C(=O)OCCCCC[N+](C)(CC)CC)C3=CC=CC=C3.[I-].[I-] |
| InChIKey | HZJNHORPHINCHO-UHFFFAOYSA-L |
📖 Product Overview
DTXSID40905661 (CAS: 10066-76-9) is a chemical compound with molecular formula C38H60I2N2O4 and molecular weight 862.7 g/mol. Its IUPAC systematic name is 5-[3-[5-[diethyl(methyl)azaniumyl]pentoxycarbonyl]-2,4-diphenylcyclobutanecarbonyl]oxypentyl-diethyl-methylazanium diiodide.
HZJNHORPHINCHO-UHFFFAOYSA-L.
SMILES: CC[N+](C)(CC)CCCCCOC(=O)C1C(C(C1C2=CC=CC=C2)C(=O)OCCCCC[N+](C)(CC)CC)C3=CC=CC=C3.[I-].[I-].
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