GZT
Summary
| Name: | 1-[[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]methyl]-~{N}-methyl-2-oxidanylidene-pyridine-3-carboxamide |
| Formula: | C15 H12 F2 N2 O4 |
| Formal charge: | 0 |
| Formula weight: | 322.264 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 1-[[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]methyl]-~{N}-methyl-2-oxidanylidene-pyridine-3-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C15H12F2N2O4/c1-18-13(20)10-3-2-6-19(14(10)21)8-9-4-5-11-12(7-9)23-15(16,17)22-11/h2-7H,8H2,1H3,(H,18,20) |
| InChIKey | InChI | 1.03 | AUOUHYVJJFEJOE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNC(=O)C1=CC=CN(Cc2ccc3OC(F)(F)Oc3c2)C1=O |
| SMILES | CACTVS | 3.385 | CNC(=O)C1=CC=CN(Cc2ccc3OC(F)(F)Oc3c2)C1=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CNC(=O)C1=CC=CN(C1=O)Cc2ccc3c(c2)OC(O3)(F)F |
| SMILES | OpenEye OEToolkits | 2.0.6 | CNC(=O)C1=CC=CN(C1=O)Cc2ccc3c(c2)OC(O3)(F)F |
