YUX
Summary
| Name: | 3-[3-(4-decylphenyl)-1,2,4-oxadiazol-5-yl]propan-1-amine |
| Formula: | C21 H33 N3 O |
| Formal charge: | 0 |
| Formula weight: | 343.506 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-[3-(4-decylphenyl)-1,2,4-oxadiazol-5-yl]propan-1-amine |
| OpenEye OEToolkits | 2.0.7 | 3-[3-(4-decylphenyl)-1,2,4-oxadiazol-5-yl]propan-1-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | CCCCCCCCCCc1ccc(cc1)c1nc(CCCN)on1 |
| InChI | InChI | 1.06 | InChI=1S/C21H33N3O/c1-2-3-4-5-6-7-8-9-11-18-13-15-19(16-14-18)21-23-20(25-24-21)12-10-17-22/h13-16H,2-12,17,22H2,1H3 |
| InChIKey | InChI | 1.06 | VLTITRMWGPJCFJ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCCCCCCCc1ccc(cc1)c2noc(CCCN)n2 |
| SMILES | CACTVS | 3.385 | CCCCCCCCCCc1ccc(cc1)c2noc(CCCN)n2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCCCCCCCc1ccc(cc1)c2nc(on2)CCCN |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCCCCCc1ccc(cc1)c2nc(on2)CCCN |
