Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | C4N(C(=O)c1ccc(cc1)N2CCOCC2)CC(N(C(C)=O)c3ccccc3)CC4 |
InChI | InChI | 1.03 | InChI=1S/C24H29N3O3/c1-19(28)27(22-6-3-2-4-7-22)23-8-5-13-26(18-23)24(29)20-9-11-21(12-10-20)25-14-16-30-17-15-25/h2-4,6-7,9-12,23H,5,8,13-18H2,1H3/t23-/m1/s1 |
InChIKey | InChI | 1.03 | ZPBAECMYHZRSTO-HSZRJFAPSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)N([C@@H]1CCCN(C1)C(=O)c2ccc(cc2)N3CCOCC3)c4ccccc4 |
SMILES | CACTVS | 3.385 | CC(=O)N([CH]1CCCN(C1)C(=O)c2ccc(cc2)N3CCOCC3)c4ccccc4 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=O)N(c1ccccc1)[C@@H]2CCCN(C2)C(=O)c3ccc(cc3)N4CCOCC4 |
SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)N(c1ccccc1)C2CCCN(C2)C(=O)c3ccc(cc3)N4CCOCC4 |