DTXSID901014964
[9-(2-ethoxycarbonylphenyl)-6-(ethylamino)-2,7-dimethylxanthen-3-ylidene]-ethylazanium chloride
| Molecular Formula | C28H31ClN2O3 |
|---|---|
| Molecular Weight | 479.0 g/mol |
| Topological Polar Surface Area | 61.5 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 478.20233 |
| Heavy Atoms | 34 |
| Complexity | 823.0 |
Chemical Identifiers
| CAS Number | 1232233-19-0 |
|---|---|
| SMILES | CCNC1=CC2=C(C=C1C)C(=C3C=C(C(=[NH+]CC)C=C3O2)C)C4=CC=CC=C4C(=O)OCC.[Cl-] |
| InChIKey | VYXSBFYARXAAKO-UHFFFAOYSA-N |
📖 Product Overview
DTXSID901014964 (CAS: 1232233-19-0) is a chemical compound with molecular formula C28H31ClN2O3 and molecular weight 479.0 g/mol. Its IUPAC systematic name is [9-(2-ethoxycarbonylphenyl)-6-(ethylamino)-2,7-dimethylxanthen-3-ylidene]-ethylazanium chloride.
VYXSBFYARXAAKO-UHFFFAOYSA-N.
SMILES: CCNC1=CC2=C(C=C1C)C(=C3C=C(C(=[NH+]CC)C=C3O2)C)C4=CC=CC=C4C(=O)OCC.[Cl-].
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