MR6
Summary
| Name: | 2-(3,5-DIMETHYLPHENYL)-1,3-BENZOXAZOLE |
| Formula: | C15 H13 N O |
| Formal charge: | 0 |
| Formula weight: | 223.27 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-(3,5-dimethylphenyl)-1,3-benzoxazole |
| OpenEye OEToolkits | 1.5.0 | 2-(3,5-dimethylphenyl)-1,3-benzoxazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n1c3ccccc3oc1c2cc(cc(c2)C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | Cc1cc(C)cc(c1)c2oc3ccccc3n2 |
| SMILES | CACTVS | 3.341 | Cc1cc(C)cc(c1)c2oc3ccccc3n2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cc1cc(cc(c1)c2nc3ccccc3o2)C |
| SMILES | OpenEye OEToolkits | 1.5.0 | Cc1cc(cc(c1)c2nc3ccccc3o2)C |
| InChI | InChI | 1.03 | InChI=1S/C15H13NO/c1-10-7-11(2)9-12(8-10)15-16-13-5-3-4-6-14(13)17-15/h3-9H,1-2H3 |
| InChIKey | InChI | 1.03 | BIHLSRJPJFOESJ-UHFFFAOYSA-N |
