P6Z
Summary
| Name: | 3-imidazol-1-ylbenzaldehyde |
| Formula: | C10 H8 N2 O |
| Formal charge: | 0 |
| Formula weight: | 172.183 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 3-imidazol-1-ylbenzaldehyde |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H8N2O/c13-7-9-2-1-3-10(6-9)12-5-4-11-8-12/h1-8H |
| InChIKey | InChI | 1.03 | CGTQCZGDVDTRDI-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=Cc1cccc(c1)n2ccnc2 |
| SMILES | CACTVS | 3.385 | O=Cc1cccc(c1)n2ccnc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)n2ccnc2)C=O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)n2ccnc2)C=O |
