5NA
Summary
| Name: | 2-hydroxy-5-methyl naphthoic acid |
| Synonyms: | 2-hydroxy-5-methylnaphthalene-1-carboxylic acid |
| Formula: | C12 H10 O3 |
| Formal charge: | 0 |
| Formula weight: | 202.206 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 11.02 | 2-hydroxy-5-methylnaphthalene-1-carboxylic acid |
| OpenEye OEToolkits | 1.6.1 | 2-hydroxy-5-methyl-naphthalene-1-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 11.02 | O=C(O)c1c2c(ccc1O)c(ccc2)C |
| SMILES_CANONICAL | CACTVS | 3.352 | Cc1cccc2c1ccc(O)c2C(O)=O |
| SMILES | CACTVS | 3.352 | Cc1cccc2c1ccc(O)c2C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | Cc1cccc2c1ccc(c2C(=O)O)O |
| SMILES | OpenEye OEToolkits | 1.7.0 | Cc1cccc2c1ccc(c2C(=O)O)O |
| InChI | InChI | 1.03 | InChI=1S/C12H10O3/c1-7-3-2-4-9-8(7)5-6-10(13)11(9)12(14)15/h2-6,13H,1H3,(H,14,15) |
| InChIKey | InChI | 1.03 | KKMAZNUSFFWQQY-UHFFFAOYSA-N |
