TLK
3-methoxy-4-(2-phenylimidazol-1-yl)benzaldehyde
Created: | 2021-01-11 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 35 |
Chiral Atom Count | 0 |
Bond Count | 37 |
Aromatic Bond Count | 17 |
Chemical Component Summary | |
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Name | 3-methoxy-4-(2-phenylimidazol-1-yl)benzaldehyde |
Systematic Name (OpenEye OEToolkits) | 3-methoxy-4-(2-phenylimidazol-1-yl)benzaldehyde |
Formula | C17 H14 N2 O2 |
Molecular Weight | 278.305 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | COc1cc(C=O)ccc1n2ccnc2c3ccccc3 |
SMILES | OpenEye OEToolkits | 2.0.7 | COc1cc(ccc1n2ccnc2c3ccccc3)C=O |
Canonical SMILES | CACTVS | 3.385 | COc1cc(C=O)ccc1n2ccnc2c3ccccc3 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | COc1cc(ccc1n2ccnc2c3ccccc3)C=O |
InChI | InChI | 1.03 | InChI=1S/C17H14N2O2/c1-21-16-11-13(12-20)7-8-15(16)19-10-9-18-17(19)14-5-3-2-4-6-14/h2-12H,1H3 |
InChIKey | InChI | 1.03 | VPVOFFUNHDIJQI-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 156022771 |