A1C9S
Summary
| Name: | N-(3-hydroxy-4-methylphenyl)furan-2-carboxamide |
| Formula: | C12 H11 N O3 |
| Formal charge: | 0 |
| Formula weight: | 217.221 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | N-(3-hydroxy-4-methylphenyl)furan-2-carboxamide |
| OpenEye OEToolkits | 3.1.0.0 | ~{N}-(4-methyl-3-oxidanyl-phenyl)furan-2-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(Nc1ccc(C)c(O)c1)c1ccco1 |
| InChI | InChI | 1.06 | InChI=1S/C12H11NO3/c1-8-4-5-9(7-10(8)14)13-12(15)11-3-2-6-16-11/h2-7,14H,1H3,(H,13,15) |
| InChIKey | InChI | 1.06 | DIPYUCDKLWIPQH-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccc(NC(=O)c2occc2)cc1O |
| SMILES | CACTVS | 3.385 | Cc1ccc(NC(=O)c2occc2)cc1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | Cc1ccc(cc1O)NC(=O)c2ccco2 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | Cc1ccc(cc1O)NC(=O)c2ccco2 |
