Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | COc1ccccc1OCCNC(=O)c1cncc2ccccc21 |
InChI | InChI | 1.06 | InChI=1S/C19H18N2O3/c1-23-17-8-4-5-9-18(17)24-11-10-21-19(22)16-13-20-12-14-6-2-3-7-15(14)16/h2-9,12-13H,10-11H2,1H3,(H,21,22) |
InChIKey | InChI | 1.06 | SWRAJWUUCVFLBR-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COc1ccccc1OCCNC(=O)c2cncc3ccccc23 |
SMILES | CACTVS | 3.385 | COc1ccccc1OCCNC(=O)c2cncc3ccccc23 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1ccccc1OCCNC(=O)c2cncc3c2cccc3 |
SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccccc1OCCNC(=O)c2cncc3c2cccc3 |