6X1
Summary
| Name: | 2-{[(3,5-dichlorophenyl)carbamoyl]amino}benzoic acid |
| Formula: | C14 H10 Cl2 N2 O3 |
| Formal charge: | 0 |
| Formula weight: | 325.147 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 1.6.1 | 2-[(3,5-dichlorophenyl)carbamoylamino]benzoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES_CANONICAL | CACTVS | 3.352 | OC(=O)c1ccccc1NC(=O)Nc2cc(Cl)cc(Cl)c2 |
| SMILES | CACTVS | 3.352 | OC(=O)c1ccccc1NC(=O)Nc2cc(Cl)cc(Cl)c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1ccc(c(c1)C(=O)O)NC(=O)Nc2cc(cc(c2)Cl)Cl |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1ccc(c(c1)C(=O)O)NC(=O)Nc2cc(cc(c2)Cl)Cl |
| InChI | InChI | 1.03 | InChI=1S/C14H10Cl2N2O3/c15-8-5-9(16)7-10(6-8)17-14(21)18-12-4-2-1-3-11(12)13(19)20/h1-7H,(H,19,20)(H2,17,18,21) |
| InChIKey | InChI | 1.03 | PIWYMPXOKMFVER-UHFFFAOYSA-N |
