O0X
Summary
| Name: | 2-(3-chlorophenyl)-N-(1,7-naphthyridin-5-yl)acetamide |
| Formula: | C16 H12 Cl N3 O |
| Formal charge: | 0 |
| Formula weight: | 297.739 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-(3-chlorophenyl)-N-(1,7-naphthyridin-5-yl)acetamide |
| OpenEye OEToolkits | 2.0.7 | 2-(3-chlorophenyl)-~{N}-(1,7-naphthyridin-5-yl)ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Clc1cccc(c1)CC(=O)Nc1cncc2ncccc21 |
| InChI | InChI | 1.06 | InChI=1S/C16H12ClN3O/c17-12-4-1-3-11(7-12)8-16(21)20-15-10-18-9-14-13(15)5-2-6-19-14/h1-7,9-10H,8H2,(H,20,21) |
| InChIKey | InChI | 1.06 | ACBAQCKSRSEYGV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Clc1cccc(CC(=O)Nc2cncc3ncccc23)c1 |
| SMILES | CACTVS | 3.385 | Clc1cccc(CC(=O)Nc2cncc3ncccc23)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)Cl)CC(=O)Nc2cncc3c2cccn3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)Cl)CC(=O)Nc2cncc3c2cccn3 |
