EYF
Summary
| Name: | 1-[(3-methoxyphenyl)methyl]-~{N}-oxidanyl-pyrrolo[2,3-b]pyridine-5-carboxamide |
| Formula: | C16 H15 N3 O3 |
| Formal charge: | 0 |
| Formula weight: | 297.309 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 1-[(3-methoxyphenyl)methyl]-~{N}-oxidanyl-pyrrolo[2,3-b]pyridine-5-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C16H15N3O3/c1-22-14-4-2-3-11(7-14)10-19-6-5-12-8-13(16(20)18-21)9-17-15(12)19/h2-9,21H,10H2,1H3,(H,18,20) |
| InChIKey | InChI | 1.03 | CUMWZHBISABRRE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cccc(Cn2ccc3cc(cnc23)C(=O)NO)c1 |
| SMILES | CACTVS | 3.385 | COc1cccc(Cn2ccc3cc(cnc23)C(=O)NO)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1cccc(c1)Cn2ccc3c2ncc(c3)C(=O)NO |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1cccc(c1)Cn2ccc3c2ncc(c3)C(=O)NO |
