Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | Fc1cccc2c1C(=O)NC(=O)N2CCCCN4CC=C(c3ccccc3)CC4 |
SMILES_CANONICAL | CACTVS | 3.341 | Fc1cccc2N(CCCCN3CCC(=CC3)c4ccccc4)C(=O)NC(=O)c12 |
SMILES | CACTVS | 3.341 | Fc1cccc2N(CCCCN3CCC(=CC3)c4ccccc4)C(=O)NC(=O)c12 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)C2=CC[N@@](CC2)CCCCN3c4cccc(c4C(=O)NC3=O)F |
SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)C2=CCN(CC2)CCCCN3c4cccc(c4C(=O)NC3=O)F |
InChI | InChI | 1.03 | InChI=1S/C23H24FN3O2/c24-19-9-6-10-20-21(19)22(28)25-23(29)27(20)14-5-4-13-26-15-11-18(12-16-26)17-7-2-1-3-8-17/h1-3,6-11H,4-5,12-16H2,(H,25,28,29) |
InChIKey | InChI | 1.03 | PNPFDRCIGCUCMN-UHFFFAOYSA-N |