XEL
Summary
| Name: | (1E)-1-[(4-chlorophenyl)methylidene]-2-(3-fluorophenyl)hydrazine |
| Formula: | C13 H10 Cl F N2 |
| Formal charge: | 0 |
| Formula weight: | 248.683 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (1E)-1-[(4-chlorophenyl)methylidene]-2-(3-fluorophenyl)hydrazine |
| OpenEye OEToolkits | 2.0.7 | ~{N}-[(4-chlorophenyl)methylideneamino]-3-fluoranyl-aniline |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Clc1ccc(/C=N/Nc2cccc(F)c2)cc1 |
| InChI | InChI | 1.06 | InChI=1S/C13H10ClFN2/c14-11-6-4-10(5-7-11)9-16-17-13-3-1-2-12(15)8-13/h1-9,17H |
| InChIKey | InChI | 1.06 | UTOSOXCDURPRKS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Fc1cccc(N\N=C\c2ccc(Cl)cc2)c1 |
| SMILES | CACTVS | 3.385 | Fc1cccc(NN=Cc2ccc(Cl)cc2)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)F)NN=Cc2ccc(cc2)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)F)NN=Cc2ccc(cc2)Cl |
