EHU
Summary
| Name: | 2-[[3-chloranyl-4-(methylamino)-2-phenyl-phenyl]amino]benzoic acid |
| Formula: | C20 H17 Cl N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 352.814 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-[[3-chloranyl-4-(methylamino)-2-phenyl-phenyl]amino]benzoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C20H17ClN2O2/c1-22-17-12-11-16(18(19(17)21)13-7-3-2-4-8-13)23-15-10-6-5-9-14(15)20(24)25/h2-12,22-23H,1H3,(H,24,25) |
| InChIKey | InChI | 1.03 | RZIPOOPDWJBCHO-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNc1ccc(Nc2ccccc2C(O)=O)c(c1Cl)c3ccccc3 |
| SMILES | CACTVS | 3.385 | CNc1ccc(Nc2ccccc2C(O)=O)c(c1Cl)c3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CNc1ccc(c(c1Cl)c2ccccc2)Nc3ccccc3C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CNc1ccc(c(c1Cl)c2ccccc2)Nc3ccccc3C(=O)O |
