| PDB CCD ID: | 20C |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C16 H11 N O5 |
| InChI: | InChI=1S/C16H11NO5/c1-8-3-2-4-11-13(8)15(20)17(14(11)19)9-5-6-10(16(21)22)12(18)7-9/h2-7,18H,1H3,(H,21,22) |
| InChIKey: | SPKSOWKQTVDRTK-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.352 | Cc1cccc2C(=O)N(c3ccc(C(O)=O)c(O)c3)C(=O)c12 | | OpenEye OEToolkits 1.7.0 | Cc1cccc2c1C(=O)N(C2=O)c3ccc(c(c3)O)C(=O)O | | ACDLabs 11.02 | O=C(O)c1ccc(cc1O)N3C(=O)c2cccc(c2C3=O)C |
|
| Name: | 2-hydroxy-4-(4-methyl-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoic acid;
2-hydroxy-4-(4-methyl-1,3-dioxo-2,3-dihydro-1H- isoindol-2-yl)benzoic acid |
| ChEMBL: | CHEMBL1229792 |
| ZINC: | ZINC000058631509 |
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