A1JRB
Summary
| Name: | 2,5-dimethyl-1-(4-methylpyridin-2-yl)pyrrole-3-carbaldehyde |
| Formula: | C13 H14 N2 O |
| Formal charge: | 0 |
| Formula weight: | 214.263 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2,5-dimethyl-1-(4-methylpyridin-2-yl)pyrrole-3-carbaldehyde |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C13H14N2O/c1-9-4-5-14-13(6-9)15-10(2)7-12(8-16)11(15)3/h4-8H,1-3H3 |
| InChIKey | InChI | 1.06 | PIGJZPZYWKFDBR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccnc(c1)n2c(C)cc(C=O)c2C |
| SMILES | CACTVS | 3.385 | Cc1ccnc(c1)n2c(C)cc(C=O)c2C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1ccnc(c1)n2c(cc(c2C)C=O)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccnc(c1)n2c(cc(c2C)C=O)C |
