Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O(c2ccc1c5c(c3c(c1c2)cc(OC)c(OC)c3)CC4N(CCCC4)C5)C |
InChI | InChI | 1.03 | InChI=1S/C24H27NO3/c1-26-16-7-8-17-19(11-16)21-13-24(28-3)23(27-2)12-20(21)18-10-15-6-4-5-9-25(15)14-22(17)18/h7-8,11-13,15H,4-6,9-10,14H2,1-3H3/t15-/m1/s1 |
InChIKey | InChI | 1.03 | RSHYSOGXGSUUIJ-OAHLLOKOSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc2c3CN4CCCC[C@@H]4Cc3c5cc(OC)c(OC)cc5c2c1 |
SMILES | CACTVS | 3.385 | COc1ccc2c3CN4CCCC[CH]4Cc3c5cc(OC)c(OC)cc5c2c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | COc1ccc2c(c1)c3cc(c(cc3c4c2CN5CCCC[C@@H]5C4)OC)OC |
SMILES | OpenEye OEToolkits | 1.9.2 | COc1ccc2c(c1)c3cc(c(cc3c4c2CN5CCCCC5C4)OC)OC |