3SQ
Summary
Name: | 4-(4-fluorophenyl)-1H-imidazole |
Formula: | C9 H7 F N2 |
Formal charge: | 0 |
Formula weight: | 162.164 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 4-(4-fluorophenyl)-1H-imidazole |
OpenEye OEToolkits | 1.9.2 | 4-(4-fluorophenyl)-1H-imidazole |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Fc2ccc(c1ncnc1)cc2 |
InChI | InChI | 1.03 | InChI=1S/C9H7FN2/c10-8-3-1-7(2-4-8)9-5-11-6-12-9/h1-6H,(H,11,12) |
InChIKey | InChI | 1.03 | QYDAFWKRBZYBOB-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Fc1ccc(cc1)c2c[nH]cn2 |
SMILES | CACTVS | 3.385 | Fc1ccc(cc1)c2c[nH]cn2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1cc(ccc1c2c[nH]cn2)F |
SMILES | OpenEye OEToolkits | 1.9.2 | c1cc(ccc1c2c[nH]cn2)F |