718
Summary
| Name: | 6-hydroxy-3,4-dihydronaphthalen-1(2H)-one |
| Formula: | C10 H10 O2 |
| Formal charge: | 0 |
| Formula weight: | 162.185 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 6-hydroxy-3,4-dihydronaphthalen-1(2H)-one |
| OpenEye OEToolkits | 2.0.5 | 6-oxidanyl-3,4-dihydro-2~{H}-naphthalen-1-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c21C(=O)CCCc1cc(cc2)O |
| InChI | InChI | 1.03 | InChI=1S/C10H10O2/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h4-6,11H,1-3H2 |
| InChIKey | InChI | 1.03 | FNSQPQKPPGALFA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Oc1ccc2C(=O)CCCc2c1 |
| SMILES | CACTVS | 3.385 | Oc1ccc2C(=O)CCCc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | c1cc2c(cc1O)CCCC2=O |
| SMILES | OpenEye OEToolkits | 2.0.5 | c1cc2c(cc1O)CCCC2=O |
