A1EAV
Summary
| Name: | 1,10-phenanthroline-2,9-dicarboxylic acid |
| Formula: | C14 H8 N2 O4 |
| Formal charge: | 0 |
| Formula weight: | 268.224 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 1,10-phenanthroline-2,9-dicarboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C14H8N2O4/c17-13(18)9-5-3-7-1-2-8-4-6-10(14(19)20)16-12(8)11(7)15-9/h1-6H,(H,17,18)(H,19,20) |
| InChIKey | InChI | 1.06 | FXSVCROWUPWXBP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1ccc2ccc3ccc(nc3c2n1)C(O)=O |
| SMILES | CACTVS | 3.385 | OC(=O)c1ccc2ccc3ccc(nc3c2n1)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc2ccc(nc2c3c1ccc(n3)C(=O)O)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc2ccc(nc2c3c1ccc(n3)C(=O)O)C(=O)O |
