I87
Summary
| Name: | (2S)-N,2-dimethyl-N-(propan-2-yl)morpholine-4-sulfonamide |
| Formula: | C9 H20 N2 O3 S |
| Formal charge: | 0 |
| Formula weight: | 236.332 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2S)-N,2-dimethyl-N-(propan-2-yl)morpholine-4-sulfonamide |
| OpenEye OEToolkits | 2.0.7 | (2~{S})-~{N},2-dimethyl-~{N}-propan-2-yl-morpholine-4-sulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | CC1CN(CCO1)S(=O)(=O)N(C)C(C)C |
| InChI | InChI | 1.03 | InChI=1S/C9H20N2O3S/c1-8(2)10(4)15(12,13)11-5-6-14-9(3)7-11/h8-9H,5-7H2,1-4H3/t9-/m0/s1 |
| InChIKey | InChI | 1.03 | XYVINBFQYYSZBX-VIFPVBQESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)N(C)[S](=O)(=O)N1CCO[C@@H](C)C1 |
| SMILES | CACTVS | 3.385 | CC(C)N(C)[S](=O)(=O)N1CCO[CH](C)C1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C[C@H]1CN(CCO1)S(=O)(=O)N(C)C(C)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC1CN(CCO1)S(=O)(=O)N(C)C(C)C |
