PJP
Summary
| Name: | N,N-diethyl-4-methylbenzene-1-sulfonamide |
| Formula: | C11 H17 N O2 S |
| Formal charge: | 0 |
| Formula weight: | 227.323 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N,N-diethyl-4-methylbenzene-1-sulfonamide |
| OpenEye OEToolkits | 2.0.6 | ~{N},~{N}-diethyl-4-methyl-benzenesulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | CCN(CC)S(c1ccc(cc1)C)(=O)=O |
| InChI | InChI | 1.03 | InChI=1S/C11H17NO2S/c1-4-12(5-2)15(13,14)11-8-6-10(3)7-9-11/h6-9H,4-5H2,1-3H3 |
| InChIKey | InChI | 1.03 | AOJBACHWNDMRQP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCN(CC)[S](=O)(=O)c1ccc(C)cc1 |
| SMILES | CACTVS | 3.385 | CCN(CC)[S](=O)(=O)c1ccc(C)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCN(CC)S(=O)(=O)c1ccc(cc1)C |
| SMILES | OpenEye OEToolkits | 2.0.6 | CCN(CC)S(=O)(=O)c1ccc(cc1)C |
