L9B
Summary
Name: | 4-(4-oxidanylbutyl)benzenesulfonamide |
Formula: | C10 H15 N O3 S |
Formal charge: | 0 |
Formula weight: | 229.296 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 4-(4-oxidanylbutyl)benzenesulfonamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C10H15NO3S/c11-15(13,14)10-6-4-9(5-7-10)3-1-2-8-12/h4-7,12H,1-3,8H2,(H2,11,13,14) |
InChIKey | InChI | 1.03 | NCRQTZXHMKBWLU-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | N[S](=O)(=O)c1ccc(CCCCO)cc1 |
SMILES | CACTVS | 3.385 | N[S](=O)(=O)c1ccc(CCCCO)cc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1CCCCO)S(=O)(=O)N |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1CCCCO)S(=O)(=O)N |