ZYX
Summary
Name: | 4-(2-AMINOETHYL)BENZENESULFONAMIDE |
Synonyms: | P-AMINOETHYL BENZENESULFONAMIDE |
Formula: | C8 H12 N2 O2 S |
Formal charge: | 0 |
Formula weight: | 200.258 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 4-(2-aminoethyl)benzenesulfonamide |
OpenEye OEToolkits | 1.5.0 | 4-(2-aminoethyl)benzenesulfonamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=S(=O)(c1ccc(cc1)CCN)N |
SMILES_CANONICAL | CACTVS | 3.341 | NCCc1ccc(cc1)[S](N)(=O)=O |
SMILES | CACTVS | 3.341 | NCCc1ccc(cc1)[S](N)(=O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1CCN)S(=O)(=O)N |
SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1CCN)S(=O)(=O)N |
InChI | InChI | 1.03 | InChI=1S/C8H12N2O2S/c9-6-5-7-1-3-8(4-2-7)13(10,11)12/h1-4H,5-6,9H2,(H2,10,11,12) |
InChIKey | InChI | 1.03 | FXNSVEQMUYPYJS-UHFFFAOYSA-N |