Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(O)C(=O)CC(=O)c3cc(N(Cc1ccccc1)Cc2ccccc2)ccc3 |
SMILES_CANONICAL | CACTVS | 3.341 | OC(=O)C(=O)CC(=O)c1cccc(c1)N(Cc2ccccc2)Cc3ccccc3 |
SMILES | CACTVS | 3.341 | OC(=O)C(=O)CC(=O)c1cccc(c1)N(Cc2ccccc2)Cc3ccccc3 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)CN(Cc2ccccc2)c3cccc(c3)C(=O)CC(=O)C(=O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)CN(Cc2ccccc2)c3cccc(c3)C(=O)CC(=O)C(=O)O |
InChI | InChI | 1.03 | InChI=1S/C24H21NO4/c26-22(15-23(27)24(28)29)20-12-7-13-21(14-20)25(16-18-8-3-1-4-9-18)17-19-10-5-2-6-11-19/h1-14H,15-17H2,(H,28,29) |
InChIKey | InChI | 1.03 | RMWVENXKUQXLPW-UHFFFAOYSA-N |