Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c2(cc(C)cc(CCc1c(F)c(F)c(c(c1)CCCN(C)C)F)n2)N |
InChI | InChI | 1.03 | InChI=1S/C19H24F3N3/c1-12-9-15(24-16(23)10-12)7-6-14-11-13(5-4-8-25(2)3)17(20)19(22)18(14)21/h9-11H,4-8H2,1-3H3,(H2,23,24) |
InChIKey | InChI | 1.03 | QBZKHLSOLPLXGI-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CN(C)CCCc1cc(CCc2cc(C)cc(N)n2)c(F)c(F)c1F |
SMILES | CACTVS | 3.385 | CN(C)CCCc1cc(CCc2cc(C)cc(N)n2)c(F)c(F)c1F |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1cc(nc(c1)N)CCc2cc(c(c(c2F)F)F)CCCN(C)C |
SMILES | OpenEye OEToolkits | 2.0.6 | Cc1cc(nc(c1)N)CCc2cc(c(c(c2F)F)F)CCCN(C)C |