7FL
Summary
| Name: | 4,4'-(cycloheptylidenemethylene)diphenol |
| Formula: | C20 H22 O2 |
| Formal charge: | 0 |
| Formula weight: | 294.387 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4,4'-(cycloheptylidenemethylene)diphenol |
| OpenEye OEToolkits | 2.0.6 | 4-[cycloheptylidene-(4-hydroxyphenyl)methyl]phenol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Oc1ccc(cc1)\C(=C2\CCCCCC2)c3ccc(O)cc3 |
| InChI | InChI | 1.03 | InChI=1S/C20H22O2/c21-18-11-7-16(8-12-18)20(15-5-3-1-2-4-6-15)17-9-13-19(22)14-10-17/h7-14,21-22H,1-6H2 |
| InChIKey | InChI | 1.03 | XVTAYJKFHUKWSR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Oc1ccc(cc1)C(=C2CCCCCC2)c3ccc(O)cc3 |
| SMILES | CACTVS | 3.385 | Oc1ccc(cc1)C(=C2CCCCCC2)c3ccc(O)cc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1C(=C2CCCCCC2)c3ccc(cc3)O)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1C(=C2CCCCCC2)c3ccc(cc3)O)O |
