STV
Summary
| Name: | ~{N}-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide |
| Formula: | C10 H13 N O4 S |
| Formal charge: | 0 |
| Formula weight: | 243.28 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | ~{N}-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H13NO4S/c1-2-16(12,13)11-6-8-3-4-9-10(5-8)15-7-14-9/h3-5,11H,2,6-7H2,1H3 |
| InChIKey | InChI | 1.03 | UKPLBUIFSDRLEZ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC[S](=O)(=O)NCc1ccc2OCOc2c1 |
| SMILES | CACTVS | 3.385 | CC[S](=O)(=O)NCc1ccc2OCOc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCS(=O)(=O)NCc1ccc2c(c1)OCO2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | CCS(=O)(=O)NCc1ccc2c(c1)OCO2 |
