Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Cc1cccc(c1)COC(=O)c1cccc2c1NC(=O)C2O |
InChI | InChI | 1.06 | InChI=1S/C17H15NO4/c1-10-4-2-5-11(8-10)9-22-17(21)13-7-3-6-12-14(13)18-16(20)15(12)19/h2-8,15,19H,9H2,1H3,(H,18,20)/t15-/m1/s1 |
InChIKey | InChI | 1.06 | BWTXNZHOZOMCDB-OAHLLOKOSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Cc1cccc(COC(=O)c2cccc3[C@@H](O)C(=O)Nc23)c1 |
SMILES | CACTVS | 3.385 | Cc1cccc(COC(=O)c2cccc3[CH](O)C(=O)Nc23)c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cccc(c1)COC(=O)c2cccc3c2NC(=O)[C@@H]3O |
SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cccc(c1)COC(=O)c2cccc3c2NC(=O)C3O |