AED
Summary
| Name: | 4-(2-aminoethyl)-2-cyclohexylphenol |
| Formula: | C14 H21 N O |
| Formal charge: | 0 |
| Formula weight: | 219.323 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 4-(2-aminoethyl)-2-cyclohexylphenol |
| OpenEye OEToolkits | 1.5.0 | 4-(2-aminoethyl)-2-cyclohexyl-phenol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | Oc1ccc(cc1C2CCCCC2)CCN |
| SMILES_CANONICAL | CACTVS | 3.341 | NCCc1ccc(O)c(c1)C2CCCCC2 |
| SMILES | CACTVS | 3.341 | NCCc1ccc(O)c(c1)C2CCCCC2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(c(cc1CCN)C2CCCCC2)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(c(cc1CCN)C2CCCCC2)O |
| InChI | InChI | 1.03 | InChI=1S/C14H21NO/c15-9-8-11-6-7-14(16)13(10-11)12-4-2-1-3-5-12/h6-7,10,12,16H,1-5,8-9,15H2 |
| InChIKey | InChI | 1.03 | DOCCSEDGBYCYLS-UHFFFAOYSA-N |
