O0F
Summary
| Name: | (6P)-4-amino-6-(2H-tetrazol-5-yl)benzene-1,3-disulfonamide |
| Formula: | C7 H9 N7 O4 S2 |
| Formal charge: | 0 |
| Formula weight: | 319.321 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (6P)-4-amino-6-(2H-tetrazol-5-yl)benzene-1,3-disulfonamide |
| OpenEye OEToolkits | 2.0.7 | 4-azanyl-6-(2~{H}-1,2,3,4-tetrazol-5-yl)benzene-1,3-disulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | NS(=O)(=O)c1cc(c(cc1N)c1n[NH]nn1)S(N)(=O)=O |
| InChI | InChI | 1.03 | InChI=1S/C7H9N7O4S2/c8-4-1-3(7-11-13-14-12-7)5(19(9,15)16)2-6(4)20(10,17)18/h1-2H,8H2,(H2,9,15,16)(H2,10,17,18)(H,11,12,13,14) |
| InChIKey | InChI | 1.03 | HZKIZEMGGDWFAS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1cc(c(cc1[S](N)(=O)=O)[S](N)(=O)=O)c2n[nH]nn2 |
| SMILES | CACTVS | 3.385 | Nc1cc(c(cc1[S](N)(=O)=O)[S](N)(=O)=O)c2n[nH]nn2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1c(c(cc(c1N)S(=O)(=O)N)S(=O)(=O)N)c2n[nH]nn2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1c(c(cc(c1N)S(=O)(=O)N)S(=O)(=O)N)c2n[nH]nn2 |
