AV7
Summary
| Name: | 3-(3-acetamidophenyl)benzoic acid |
| Formula: | C15 H13 N O3 |
| Formal charge: | 0 |
| Formula weight: | 255.269 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 3-(3-acetamidophenyl)benzoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C15H13NO3/c1-10(17)16-14-7-3-5-12(9-14)11-4-2-6-13(8-11)15(18)19/h2-9H,1H3,(H,16,17)(H,18,19) |
| InChIKey | InChI | 1.03 | PKQLIAIJVCDASV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)Nc1cccc(c1)c2cccc(c2)C(O)=O |
| SMILES | CACTVS | 3.385 | CC(=O)Nc1cccc(c1)c2cccc(c2)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC(=O)Nc1cccc(c1)c2cccc(c2)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | CC(=O)Nc1cccc(c1)c2cccc(c2)C(=O)O |
