17C
Summary
| Name: | 2,2'-iminodibenzoic acid |
| Formula: | C14 H11 N O4 |
| Formal charge: | 0 |
| Formula weight: | 257.241 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2,2'-iminodibenzoic acid |
| OpenEye OEToolkits | 1.7.0 | 2-[(2-carboxyphenyl)amino]benzoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)c2c(Nc1ccccc1C(=O)O)cccc2 |
| SMILES_CANONICAL | CACTVS | 3.370 | OC(=O)c1ccccc1Nc2ccccc2C(O)=O |
| SMILES | CACTVS | 3.370 | OC(=O)c1ccccc1Nc2ccccc2C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1ccc(c(c1)C(=O)O)Nc2ccccc2C(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1ccc(c(c1)C(=O)O)Nc2ccccc2C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C14H11NO4/c16-13(17)9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)14(18)19/h1-8,15H,(H,16,17)(H,18,19) |
| InChIKey | InChI | 1.03 | ZFRNOTZQUGWMQN-UHFFFAOYSA-N |
