UOT
4-(2-chloranyl-6-methoxy-benzimidazol-1-yl)benzaldehyde
Created: | 2021-03-03 |
Last modified: | 2024-09-27 |
Find Related PDB Entry |
---|
Find related ligands: |
---|
Chemical Details | |
---|---|
Formal Charge | 0 |
Atom Count | 31 |
Chiral Atom Count | 0 |
Bond Count | 33 |
Aromatic Bond Count | 16 |
Chemical Component Summary | |
---|---|
Name | 4-(2-chloranyl-6-methoxy-benzimidazol-1-yl)benzaldehyde |
Systematic Name (OpenEye OEToolkits) | 4-(2-chloranyl-6-methoxy-benzimidazol-1-yl)benzaldehyde |
Formula | C15 H11 Cl N2 O2 |
Molecular Weight | 286.713 |
Type | NON-POLYMER |
Chemical Descriptors | |||
---|---|---|---|
Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | COc1ccc2nc(Cl)n(c3ccc(C=O)cc3)c2c1 |
SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc2c(c1)n(c(n2)Cl)c3ccc(cc3)C=O |
Canonical SMILES | CACTVS | 3.385 | COc1ccc2nc(Cl)n(c3ccc(C=O)cc3)c2c1 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc2c(c1)n(c(n2)Cl)c3ccc(cc3)C=O |
InChI | InChI | 1.03 | InChI=1S/C15H11ClN2O2/c1-20-12-6-7-13-14(8-12)18(15(16)17-13)11-4-2-10(9-19)3-5-11/h2-9H,1H3 |
InChIKey | InChI | 1.03 | RILHAONIURTARS-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
---|---|
PubChem | 155923735 |