2-[2-[(5-chloro-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)oxy]ethoxy]ethyl-dimethylazanium2-hydroxy-2-oxoacetate
2-[2-[(5-chloro-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)oxy]ethoxy]ethyl-dimethylazanium;2-hydroxy-2-oxoacetate
| Molecular Formula | C23H28ClNO6 |
|---|---|
| Molecular Weight | 449.9 g/mol |
| Topological Polar Surface Area | 100.0 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 449.16052 |
| Heavy Atoms | 31 |
| Complexity | 470.0 |
Chemical Identifiers
| CAS Number | 15475-50-0 |
|---|---|
| SMILES | C[NH+](C)CCOCCOC1C2=CC=CC=C2CCC3=C1C=C(C=C3)Cl.C(=O)(C(=O)[O-])O |
| InChIKey | AURFLKOYAIUJIM-UHFFFAOYSA-N |
📖 Product Overview
2-[2-[(5-chloro-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)oxy]ethoxy]ethyl-dimethylazanium2-hydroxy-2-oxoacetate (CAS: 15475-50-0) is a chemical compound with molecular formula C23H28ClNO6 and molecular weight 449.9 g/mol. Its IUPAC systematic name is 2-[2-[(5-chloro-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)oxy]ethoxy]ethyl-dimethylazanium;2-hydroxy-2-oxoacetate.
AURFLKOYAIUJIM-UHFFFAOYSA-N.
SMILES: C[NH+](C)CCOCCOC1C2=CC=CC=C2CCC3=C1C=C(C=C3)Cl.C(=O)(C(=O)[O-])O.
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