4NA
Summary
| Name: | 1-CHLORO-6-(4-HYDROXYPHENYL)-2-NAPHTHOL |
| Formula: | C16 H11 Cl O2 |
| Formal charge: | 0 |
| Formula weight: | 270.71 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 1-chloro-6-(4-hydroxyphenyl)naphthalen-2-ol |
| OpenEye OEToolkits | 1.5.0 | 1-chloro-6-(4-hydroxyphenyl)naphthalen-2-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | Clc2c(O)ccc1cc(ccc12)c3ccc(O)cc3 |
| SMILES_CANONICAL | CACTVS | 3.341 | Oc1ccc(cc1)c2ccc3c(Cl)c(O)ccc3c2 |
| SMILES | CACTVS | 3.341 | Oc1ccc(cc1)c2ccc3c(Cl)c(O)ccc3c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1c2ccc3c(c2)ccc(c3Cl)O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1c2ccc3c(c2)ccc(c3Cl)O)O |
| InChI | InChI | 1.03 | InChI=1S/C16H11ClO2/c17-16-14-7-3-11(9-12(14)4-8-15(16)19)10-1-5-13(18)6-2-10/h1-9,18-19H |
| InChIKey | InChI | 1.03 | YHEHVRSGKUYDON-UHFFFAOYSA-N |
