ZTW
Summary
| Name: | RALOXIFENE CORE |
| Formula: | C14 H10 O2 S |
| Formal charge: | 0 |
| Formula weight: | 242.293 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-(4-hydroxyphenyl)-1-benzothiophene-6-ol |
| OpenEye OEToolkits | 1.5.0 | 2-(4-hydroxyphenyl)-1-benzothiophen-6-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | Oc3ccc(c2sc1cc(O)ccc1c2)cc3 |
| SMILES_CANONICAL | CACTVS | 3.341 | Oc1ccc(cc1)c2sc3cc(O)ccc3c2 |
| SMILES | CACTVS | 3.341 | Oc1ccc(cc1)c2sc3cc(O)ccc3c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1c2cc3ccc(cc3s2)O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1c2cc3ccc(cc3s2)O)O |
| InChI | InChI | 1.03 | InChI=1S/C14H10O2S/c15-11-4-1-9(2-5-11)13-7-10-3-6-12(16)8-14(10)17-13/h1-8,15-16H |
| InChIKey | InChI | 1.03 | MDGWZLQPNOETLH-UHFFFAOYSA-N |
