Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C24H23NO3/c25-24(23(26)27)13-12-17-10-11-21(14-20(17)15-24)28-16-19-8-4-5-9-22(19)18-6-2-1-3-7-18/h1-11,14H,12-13,15-16,25H2,(H,26,27)/t24-/m0/s1 |
InChIKey | InChI | 1.03 | WYFYXQDJHCIQGH-DEOSSOPVSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | N[C@]1(CCc2ccc(OCc3ccccc3c4ccccc4)cc2C1)C(O)=O |
SMILES | CACTVS | 3.385 | N[C]1(CCc2ccc(OCc3ccccc3c4ccccc4)cc2C1)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)c2ccccc2COc3ccc4c(c3)C[C@@](CC4)(C(=O)O)N |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)c2ccccc2COc3ccc4c(c3)CC(CC4)(C(=O)O)N |