Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C4N2CCc1c(cccc1)C2CN(C(=O)C3CCCCC3)C4 |
SMILES_CANONICAL | CACTVS | 3.341 | O=C1CN(C[C@@H]2N1CCc3ccccc23)C(=O)C4CCCCC4 |
SMILES | CACTVS | 3.341 | O=C1CN(C[CH]2N1CCc3ccccc23)C(=O)C4CCCCC4 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)CCN3[C@H]2CN(CC3=O)C(=O)C4CCCCC4 |
SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)CCN3C2CN(CC3=O)C(=O)C4CCCCC4 |
InChI | InChI | 1.03 | InChI=1S/C19H24N2O2/c22-18-13-20(19(23)15-7-2-1-3-8-15)12-17-16-9-5-4-6-14(16)10-11-21(17)18/h4-6,9,15,17H,1-3,7-8,10-13H2/t17-/m0/s1 |
InChIKey | InChI | 1.03 | FSVJFNAIGNNGKK-KRWDZBQOSA-N |