Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | OC(=O)C1CCCN1C(=O)Nc1ccccc1c1ccccc1 |
InChI | InChI | 1.06 | InChI=1S/C18H18N2O3/c21-17(22)16-11-6-12-20(16)18(23)19-15-10-5-4-9-14(15)13-7-2-1-3-8-13/h1-5,7-10,16H,6,11-12H2,(H,19,23)(H,21,22)/t16-/m0/s1 |
InChIKey | InChI | 1.06 | FNKODVVRWXUHMU-INIZCTEOSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)[C@H]1CCCN1C(=O)Nc2ccccc2c3ccccc3 |
SMILES | CACTVS | 3.385 | OC(=O)[CH]1CCCN1C(=O)Nc2ccccc2c3ccccc3 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)c2ccccc2NC(=O)N3CCC[C@@H]3C(=O)O |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)c2ccccc2NC(=O)N3CCCC3C(=O)O |