EZ1
Summary
| Name: | 4-[(prop-2-en-1-yl)selanyl]benzene-1-sulfonamide |
| Formula: | C9 H11 N O2 S Se |
| Formal charge: | 0 |
| Formula weight: | 276.214 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-[(prop-2-en-1-yl)selanyl]benzene-1-sulfonamide |
| OpenEye OEToolkits | 2.0.6 | 4-prop-2-enylselanylbenzenesulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1c(ccc(c1)[Se]C[C@H]=C)S(N)(=O)=O |
| InChI | InChI | 1.03 | InChI=1S/C9H11NO2SSe/c1-2-7-14-9-5-3-8(4-6-9)13(10,11)12/h2-6H,1,7H2,(H2,10,11,12) |
| InChIKey | InChI | 1.03 | KMBXWUNECGFGKU-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[S](=O)(=O)c1ccc([Se]CC=C)cc1 |
| SMILES | CACTVS | 3.385 | N[S](=O)(=O)c1ccc([Se]CC=C)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | C=CC[Se]c1ccc(cc1)S(=O)(=O)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | C=CC[Se]c1ccc(cc1)S(=O)(=O)N |
