UFH
2-bromanyl-4-imidazol-1-yl-benzaldehyde
Created: | 2021-02-12 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 21 |
Chiral Atom Count | 0 |
Bond Count | 22 |
Aromatic Bond Count | 11 |
Chemical Component Summary | |
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Name | 2-bromanyl-4-imidazol-1-yl-benzaldehyde |
Systematic Name (OpenEye OEToolkits) | 2-bromanyl-4-imidazol-1-yl-benzaldehyde |
Formula | C10 H7 Br N2 O |
Molecular Weight | 251.079 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | Brc1cc(ccc1C=O)n2ccnc2 |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c(cc1n2ccnc2)Br)C=O |
Canonical SMILES | CACTVS | 3.385 | Brc1cc(ccc1C=O)n2ccnc2 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c(cc1n2ccnc2)Br)C=O |
InChI | InChI | 1.03 | InChI=1S/C10H7BrN2O/c11-10-5-9(2-1-8(10)6-14)13-4-3-12-7-13/h1-7H |
InChIKey | InChI | 1.03 | KDYPLUPJLQBYJO-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 84707363 |