| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(CC1=C(C)C=C(C)NC1=O)N1CCCC(C1)C(N)=O |
| InChI | InChI | 1.06 | InChI=1S/C15H21N3O3/c1-9-6-10(2)17-15(21)12(9)7-13(19)18-5-3-4-11(8-18)14(16)20/h6,11H,3-5,7-8H2,1-2H3,(H2,16,20)(H,17,21)/t11-/m0/s1 |
| InChIKey | InChI | 1.06 | BAOPJNLBCKGSSV-NSHDSACASA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC1=CC(=C(CC(=O)N2CCC[C@@H](C2)C(N)=O)C(=O)N1)C |
| SMILES | CACTVS | 3.385 | CC1=CC(=C(CC(=O)N2CCC[CH](C2)C(N)=O)C(=O)N1)C |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CC1=CC(=C(C(=O)N1)CC(=O)N2CCC[C@@H](C2)C(=O)N)C |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC1=CC(=C(C(=O)N1)CC(=O)N2CCCC(C2)C(=O)N)C |
