Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C21H18N2O4/c1-27-19-12-11-17(21(25)23-26)13-18(19)22-20(24)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-13,26H,1H3,(H,22,24)(H,23,25) |
InChIKey | InChI | 1.03 | MRHRACKJKBOJEI-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(cc1NC(=O)c2ccc(cc2)c3ccccc3)C(=O)NO |
SMILES | CACTVS | 3.385 | COc1ccc(cc1NC(=O)c2ccc(cc2)c3ccccc3)C(=O)NO |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | COc1ccc(cc1NC(=O)c2ccc(cc2)c3ccccc3)C(=O)NO |
SMILES | OpenEye OEToolkits | 2.0.6 | COc1ccc(cc1NC(=O)c2ccc(cc2)c3ccccc3)C(=O)NO |