P1F
Summary
| Name: | 2-(2-azanylphenoxy)-5-hexyl-phenol |
| Formula: | C18 H23 N O2 |
| Formal charge: | 0 |
| Formula weight: | 285.381 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-(2-aminophenoxy)-5-hexylphenol |
| OpenEye OEToolkits | 1.9.2 | 2-(2-azanylphenoxy)-5-hexyl-phenol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O(c1c(N)cccc1)c2ccc(cc2O)CCCCCC |
| InChI | InChI | 1.03 | InChI=1S/C18H23NO2/c1-2-3-4-5-8-14-11-12-18(16(20)13-14)21-17-10-7-6-9-15(17)19/h6-7,9-13,20H,2-5,8,19H2,1H3 |
| InChIKey | InChI | 1.03 | UGZFBZMADDXZRA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCCCc1ccc(Oc2ccccc2N)c(O)c1 |
| SMILES | CACTVS | 3.385 | CCCCCCc1ccc(Oc2ccccc2N)c(O)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CCCCCCc1ccc(c(c1)O)Oc2ccccc2N |
| SMILES | OpenEye OEToolkits | 1.9.2 | CCCCCCc1ccc(c(c1)O)Oc2ccccc2N |
