PSY
Summary
Name: | phenyl ethenesulfonate |
Formula: | C8 H8 O3 S |
Formal charge: | 0 |
Formula weight: | 184.212 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | phenyl ethenesulfonate |
OpenEye OEToolkits | 1.5.0 | phenyl ethenesulfonate |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=S(=O)(Oc1ccccc1)\C=C |
SMILES_CANONICAL | CACTVS | 3.341 | C=C[S](=O)(=O)Oc1ccccc1 |
SMILES | CACTVS | 3.341 | C=C[S](=O)(=O)Oc1ccccc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C=CS(=O)(=O)Oc1ccccc1 |
SMILES | OpenEye OEToolkits | 1.5.0 | C=CS(=O)(=O)Oc1ccccc1 |
InChI | InChI | 1.03 | InChI=1S/C8H8O3S/c1-2-12(9,10)11-8-6-4-3-5-7-8/h2-7H,1H2 |
InChIKey | InChI | 1.03 | CILDJVVXNMDAGY-UHFFFAOYSA-N |