B3F
Summary
| Name: | ~{N}-[2-[(3-pentoxyphenyl)amino]phenyl]propanamide |
| Formula: | C20 H26 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 326.433 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-[2-[(3-pentoxyphenyl)amino]phenyl]propanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C20H26N2O2/c1-3-5-8-14-24-17-11-9-10-16(15-17)21-18-12-6-7-13-19(18)22-20(23)4-2/h6-7,9-13,15,21H,3-5,8,14H2,1-2H3,(H,22,23) |
| InChIKey | InChI | 1.06 | PLPSUHSYADCJSK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCCOc1cccc(Nc2ccccc2NC(=O)CC)c1 |
| SMILES | CACTVS | 3.385 | CCCCCOc1cccc(Nc2ccccc2NC(=O)CC)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCCOc1cccc(c1)Nc2ccccc2NC(=O)CC |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCOc1cccc(c1)Nc2ccccc2NC(=O)CC |
