SKF
Summary
| Name: | 1,2,3,4-TETRAHYDRO-ISOQUINOLINE-7-SULFONIC ACID AMIDE |
| Formula: | C9 H12 N2 O2 S |
| Formal charge: | 0 |
| Formula weight: | 212.269 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 1,2,3,4-tetrahydroisoquinoline-7-sulfonamide |
| OpenEye OEToolkits | 1.5.0 | 1,2,3,4-tetrahydroisoquinoline-7-sulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=S(=O)(c1ccc2c(c1)CNCC2)N |
| SMILES_CANONICAL | CACTVS | 3.341 | N[S](=O)(=O)c1ccc2CCNCc2c1 |
| SMILES | CACTVS | 3.341 | N[S](=O)(=O)c1ccc2CCNCc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc2c(cc1S(=O)(=O)N)CNCC2 |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc2c(cc1S(=O)(=O)N)CNCC2 |
| InChI | InChI | 1.03 | InChI=1S/C9H12N2O2S/c10-14(12,13)9-2-1-7-3-4-11-6-8(7)5-9/h1-2,5,11H,3-4,6H2,(H2,10,12,13) |
| InChIKey | InChI | 1.03 | UGLLZXSYRBMNOS-UHFFFAOYSA-N |
