ECR
Summary
Name: | 2-azanyl-5-fluoranyl-4-imidazol-1-yl-quinolin-8-ol |
Formula: | C12 H9 F N4 O |
Formal charge: | 0 |
Formula weight: | 244.224 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 2-azanyl-5-fluoranyl-4-imidazol-1-yl-quinolin-8-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C12H9FN4O/c13-7-1-2-9(18)12-11(7)8(5-10(14)16-12)17-4-3-15-6-17/h1-6,18H,(H2,14,16) |
InChIKey | InChI | 1.03 | GTPKCMGAPYYKBH-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Nc1cc(n2ccnc2)c3c(F)ccc(O)c3n1 |
SMILES | CACTVS | 3.385 | Nc1cc(n2ccnc2)c3c(F)ccc(O)c3n1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(c2c(cc(nc2c1O)N)n3ccnc3)F |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c2c(cc(nc2c1O)N)n3ccnc3)F |