Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)C2N(c1ccccc1C2)C(=O)OCc3ccccc3 |
SMILES_CANONICAL | CACTVS | 3.370 | OC(=O)[C@H]1Cc2ccccc2N1C(=O)OCc3ccccc3 |
SMILES | CACTVS | 3.370 | OC(=O)[CH]1Cc2ccccc2N1C(=O)OCc3ccccc3 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1ccc(cc1)COC(=O)N2c3ccccc3C[C@@H]2C(=O)O |
SMILES | OpenEye OEToolkits | 1.7.0 | c1ccc(cc1)COC(=O)N2c3ccccc3CC2C(=O)O |
InChI | InChI | 1.03 | InChI=1S/C17H15NO4/c19-16(20)15-10-13-8-4-5-9-14(13)18(15)17(21)22-11-12-6-2-1-3-7-12/h1-9,15H,10-11H2,(H,19,20)/t15-/m1/s1 |
InChIKey | InChI | 1.03 | BSOYWTITVKXHLM-OAHLLOKOSA-N |