P5O
Summary
| Name: | 5-[(~{E})-2-(3-methoxy-4-oxidanyl-phenyl)ethenyl]benzene-1,3-diol |
| Formula: | C15 H14 O4 |
| Formal charge: | 0 |
| Formula weight: | 258.269 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 5-[(~{E})-2-(3-methoxy-4-oxidanyl-phenyl)ethenyl]benzene-1,3-diol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C15H14O4/c1-19-15-8-10(4-5-14(15)18)2-3-11-6-12(16)9-13(17)7-11/h2-9,16-18H,1H3/b3-2+ |
| InChIKey | InChI | 1.06 | ANNNBEZJTNCXHY-NSCUHMNNSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cc(ccc1O)/C=C/c2cc(O)cc(O)c2 |
| SMILES | CACTVS | 3.385 | COc1cc(ccc1O)C=Cc2cc(O)cc(O)c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1cc(ccc1O)/C=C/c2cc(cc(c2)O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1cc(ccc1O)C=Cc2cc(cc(c2)O)O |
