PWT
Summary
| Name: | 2-[[2-(5-oxidanylidenepentanoyl)hydrazinyl]methyl]benzoic acid |
| Formula: | C13 H16 N2 O4 |
| Formal charge: | 0 |
| Formula weight: | 264.277 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-[[2-(5-oxidanylidenepentanoyl)hydrazinyl]methyl]benzoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C13H16N2O4/c16-8-4-3-7-12(17)15-14-9-10-5-1-2-6-11(10)13(18)19/h1-2,5-6,8,14H,3-4,7,9H2,(H,15,17)(H,18,19) |
| InChIKey | InChI | 1.03 | WAEOIFKXEDZIQC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1ccccc1CNNC(=O)CCCC=O |
| SMILES | CACTVS | 3.385 | OC(=O)c1ccccc1CNNC(=O)CCCC=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(c(c1)CNNC(=O)CCCC=O)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(c(c1)CNNC(=O)CCCC=O)C(=O)O |
