RA(sub 19)
2-[4-(5,7-dioxo-2,3-dihydro-[1,4]dithiino[2,3-c]pyrrol-6-yl)phenoxy]ethyl-diethylazanium chloride
| Molecular Formula | C18H23ClN2O3S2 |
|---|---|
| Molecular Weight | 415.0 g/mol |
| Topological Polar Surface Area | 102.0 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 414.08386 |
| Heavy Atoms | 26 |
| Complexity | 512.0 |
Chemical Identifiers
| CAS Number | 54627-08-6 |
|---|---|
| SMILES | CC[NH+](CC)CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)SCCS3.[Cl-] |
| InChIKey | BWPOXJQNBBOXKV-UHFFFAOYSA-N |
📖 Product Overview
RA(sub 19) (CAS: 54627-08-6) is a chemical compound with molecular formula C18H23ClN2O3S2 and molecular weight 415.0 g/mol. Its IUPAC systematic name is 2-[4-(5,7-dioxo-2,3-dihydro-[1,4]dithiino[2,3-c]pyrrol-6-yl)phenoxy]ethyl-diethylazanium chloride.
BWPOXJQNBBOXKV-UHFFFAOYSA-N.
SMILES: CC[NH+](CC)CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)SCCS3.[Cl-].
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