Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(NC3C1CC2CC(C1)CC3C2)C4N(CC)CCC4 |
SMILES_CANONICAL | CACTVS | 3.370 | CCN1CCC[C@@H]1C(=O)NC2C3CC4CC(C3)CC2C4 |
SMILES | CACTVS | 3.370 | CCN1CCC[CH]1C(=O)NC2C3CC4CC(C3)CC2C4 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | CC[N@]1CCC[C@@H]1C(=O)NC2C3CC4CC(C3)CC2C4 |
SMILES | OpenEye OEToolkits | 1.7.2 | CCN1CCCC1C(=O)NC2C3CC4CC(C3)CC2C4 |
InChI | InChI | 1.03 | InChI=1S/C17H28N2O/c1-2-19-5-3-4-15(19)17(20)18-16-13-7-11-6-12(9-13)10-14(16)8-11/h11-16H,2-10H2,1H3,(H,18,20)/t11-,12+,13-,14+,15-,16-/m1/s1 |
InChIKey | InChI | 1.03 | UJRJQNDIYCDCNX-ZTYXSZCMSA-N |