Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | C2(N(C(Cc1ccccc1)C(=O)Nc3c2cccc3)C)=O |
InChI | InChI | 1.03 | InChI=1S/C17H16N2O2/c1-19-15(11-12-7-3-2-4-8-12)16(20)18-14-10-6-5-9-13(14)17(19)21/h2-10,15H,11H2,1H3,(H,18,20)/t15-/m0/s1 |
InChIKey | InChI | 1.03 | KSQNKZMAMGACTL-HNNXBMFYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CN1[C@@H](Cc2ccccc2)C(=O)Nc3ccccc3C1=O |
SMILES | CACTVS | 3.385 | CN1[CH](Cc2ccccc2)C(=O)Nc3ccccc3C1=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CN1[C@H](C(=O)Nc2ccccc2C1=O)Cc3ccccc3 |
SMILES | OpenEye OEToolkits | 1.9.2 | CN1C(C(=O)Nc2ccccc2C1=O)Cc3ccccc3 |