UG5
4-[4-(trifluoromethyl)imidazol-1-yl]benzaldehyde
Created: | 2021-02-16 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 24 |
Chiral Atom Count | 0 |
Bond Count | 25 |
Aromatic Bond Count | 11 |
Chemical Component Summary | |
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Name | 4-[4-(trifluoromethyl)imidazol-1-yl]benzaldehyde |
Systematic Name (OpenEye OEToolkits) | 4-[4-(trifluoromethyl)imidazol-1-yl]benzaldehyde |
Formula | C11 H7 F3 N2 O |
Molecular Weight | 240.181 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | FC(F)(F)c1cn(cn1)c2ccc(C=O)cc2 |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1C=O)n2cc(nc2)C(F)(F)F |
Canonical SMILES | CACTVS | 3.385 | FC(F)(F)c1cn(cn1)c2ccc(C=O)cc2 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1C=O)n2cc(nc2)C(F)(F)F |
InChI | InChI | 1.03 | InChI=1S/C11H7F3N2O/c12-11(13,14)10-5-16(7-15-10)9-3-1-8(6-17)2-4-9/h1-7H |
InChIKey | InChI | 1.03 | CZOGMUWEFPDSOJ-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 156022779 |