| 種別 | プログラム | バージョン | 表記 |
| InChI | InChI | 1.03 | InChI=1S/C23H29NO6/c1-8-13-23(19(25)28-6,20(26)29-7)14-17-15(2)24(21(27)30-22(3,4)5)18-12-10-9-11-16(17)18/h8-12H,1,13-14H2,2-7H3 |
| InChIKey | InChI | 1.03 | VQJBZVFHBQAIGG-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COC(=O)C(CC=C)(Cc1c(C)n(C(=O)OC(C)(C)C)c2ccccc12)C(=O)OC |
| SMILES | CACTVS | 3.385 | COC(=O)C(CC=C)(Cc1c(C)n(C(=O)OC(C)(C)C)c2ccccc12)C(=O)OC |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1c(c2ccccc2n1C(=O)OC(C)(C)C)CC(CC=C)(C(=O)OC)C(=O)OC |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1c(c2ccccc2n1C(=O)OC(C)(C)C)CC(CC=C)(C(=O)OC)C(=O)OC |
