8RM
Summary
| Name: | N-methylquinoline-3-carboxamide |
| Formula: | C11 H10 N2 O |
| Formal charge: | 0 |
| Formula weight: | 186.21 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-methylquinoline-3-carboxamide |
| OpenEye OEToolkits | 2.0.6 | ~{N}-methylquinoline-3-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N(C(=O)c2cc1ccccc1nc2)C |
| InChI | InChI | 1.03 | InChI=1S/C11H10N2O/c1-12-11(14)9-6-8-4-2-3-5-10(8)13-7-9/h2-7H,1H3,(H,12,14) |
| InChIKey | InChI | 1.03 | PEYHZNNTTOIDDW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNC(=O)c1cnc2ccccc2c1 |
| SMILES | CACTVS | 3.385 | CNC(=O)c1cnc2ccccc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CNC(=O)c1cc2ccccc2nc1 |
| SMILES | OpenEye OEToolkits | 2.0.6 | CNC(=O)c1cc2ccccc2nc1 |
