7G3
Summary
| Name: | 3-[(Z)-(hydroxyimino)methyl][1,1'-biphenyl]-4,4'-diol |
| Formula: | C13 H11 N O3 |
| Formal charge: | 0 |
| Formula weight: | 229.231 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-[(Z)-(hydroxyimino)methyl][1,1'-biphenyl]-4,4'-diol |
| OpenEye OEToolkits | 2.0.6 | 2-[(~{Z})-hydroxyiminomethyl]-4-(4-hydroxyphenyl)phenol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Oc2ccc(c1cc(\C=N/O)c(O)cc1)cc2 |
| InChI | InChI | 1.03 | InChI=1S/C13H11NO3/c15-12-4-1-9(2-5-12)10-3-6-13(16)11(7-10)8-14-17/h1-8,15-17H/b14-8- |
| InChIKey | InChI | 1.03 | INQGQXOIWVULMW-ZSOIEALJSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O\N=C/c1cc(ccc1O)c2ccc(O)cc2 |
| SMILES | CACTVS | 3.385 | ON=Cc1cc(ccc1O)c2ccc(O)cc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1c2ccc(c(c2)/C=N\O)O)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1c2ccc(c(c2)C=NO)O)O |
