QAU
3-oxidanylbenzenesulfonamide
| Created: | 2022-10-17 |
| Last modified: | 2023-03-08 |
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Chemical Details | |
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| Formal Charge | 0 |
| Atom Count | 18 |
| Chiral Atom Count | 0 |
| Bond Count | 18 |
| Aromatic Bond Count | 6 |
Chemical Component Summary | |
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| Name | 3-oxidanylbenzenesulfonamide |
| Systematic Name (OpenEye OEToolkits) | 3-oxidanylbenzenesulfonamide |
| Formula | C6 H7 N O3 S |
| Molecular Weight | 173.19 |
| Type | NON-POLYMER |
Chemical Descriptors | |||
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| Type | Program | Version | Descriptor |
| SMILES | CACTVS | 3.385 | N[S](=O)(=O)c1cccc(O)c1 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1cc(cc(c1)S(=O)(=O)N)O |
| Canonical SMILES | CACTVS | 3.385 | N[S](=O)(=O)c1cccc(O)c1 |
| Canonical SMILES | OpenEye OEToolkits | 3.1.0.0 | c1cc(cc(c1)S(=O)(=O)N)O |
| InChI | InChI | 1.06 | InChI=1S/C6H7NO3S/c7-11(9,10)6-3-1-2-5(8)4-6/h1-4,8H,(H2,7,9,10) |
| InChIKey | InChI | 1.06 | OQPPWRYNXRWUAQ-UHFFFAOYSA-N |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 637557 |
