7MX
Summary
| Name: | ethyl 4-chloranyl-1-methyl-6-oxidanylidene-pyridine-3-carboxylate |
| Formula: | C9 H10 Cl N O3 |
| Formal charge: | 0 |
| Formula weight: | 215.634 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | ethyl 4-chloranyl-1-methyl-6-oxidanylidene-pyridine-3-carboxylate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C9H10ClNO3/c1-3-14-9(13)6-5-11(2)8(12)4-7(6)10/h4-5H,3H2,1-2H3 |
| InChIKey | InChI | 1.03 | WGSWOEOJYNQPRP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCOC(=O)C1=CN(C)C(=O)C=C1Cl |
| SMILES | CACTVS | 3.385 | CCOC(=O)C1=CN(C)C(=O)C=C1Cl |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCOC(=O)C1=CN(C(=O)C=C1Cl)C |
| SMILES | OpenEye OEToolkits | 2.0.6 | CCOC(=O)C1=CN(C(=O)C=C1Cl)C |
