W6K
Summary
| Name: | 2-[(3-chloranyl-2-phenyl-phenyl)amino]-6-methyl-benzoic acid |
| Formula: | C20 H16 Cl N O2 |
| Formal charge: | 0 |
| Formula weight: | 337.8 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-[(3-chloranyl-2-phenyl-phenyl)amino]-6-methyl-benzoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C20H16ClNO2/c1-13-7-5-11-16(18(13)20(23)24)22-17-12-6-10-15(21)19(17)14-8-3-2-4-9-14/h2-12,22H,1H3,(H,23,24) |
| InChIKey | InChI | 1.06 | RETKATZYCRROBY-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cccc(Nc2cccc(Cl)c2c3ccccc3)c1C(O)=O |
| SMILES | CACTVS | 3.385 | Cc1cccc(Nc2cccc(Cl)c2c3ccccc3)c1C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cccc(c1C(=O)O)Nc2cccc(c2c3ccccc3)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cccc(c1C(=O)O)Nc2cccc(c2c3ccccc3)Cl |
