4BS
Summary
| Name: | 4-amino-N-[4-(benzyloxy)phenyl]butanamide |
| Formula: | C17 H20 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 284.353 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 4-amino-N-[4-(benzyloxy)phenyl]butanamide |
| OpenEye OEToolkits | 1.5.0 | 4-amino-N-(4-phenylmethoxyphenyl)butanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(Nc2ccc(OCc1ccccc1)cc2)CCCN |
| SMILES_CANONICAL | CACTVS | 3.341 | NCCCC(=O)Nc1ccc(OCc2ccccc2)cc1 |
| SMILES | CACTVS | 3.341 | NCCCC(=O)Nc1ccc(OCc2ccccc2)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)COc2ccc(cc2)NC(=O)CCCN |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)COc2ccc(cc2)NC(=O)CCCN |
| InChI | InChI | 1.03 | InChI=1S/C17H20N2O2/c18-12-4-7-17(20)19-15-8-10-16(11-9-15)21-13-14-5-2-1-3-6-14/h1-3,5-6,8-11H,4,7,12-13,18H2,(H,19,20) |
| InChIKey | InChI | 1.03 | QTWBKNVNGVYTNZ-UHFFFAOYSA-N |
