8JX
Summary
| Name: | 5-[(4-methoxynaphthalen-1-yl)sulfonylamino]pentanoic acid |
| Formula: | C16 H19 N O5 S |
| Formal charge: | 0 |
| Formula weight: | 337.391 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 5-[(4-methoxynaphthalen-1-yl)sulfonylamino]pentanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C16H19NO5S/c1-22-14-9-10-15(13-7-3-2-6-12(13)14)23(20,21)17-11-5-4-8-16(18)19/h2-3,6-7,9-10,17H,4-5,8,11H2,1H3,(H,18,19) |
| InChIKey | InChI | 1.03 | ZPHHWDJVJHTZHN-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(c2ccccc12)[S](=O)(=O)NCCCCC(O)=O |
| SMILES | CACTVS | 3.385 | COc1ccc(c2ccccc12)[S](=O)(=O)NCCCCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | COc1ccc(c2c1cccc2)S(=O)(=O)NCCCCC(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | COc1ccc(c2c1cccc2)S(=O)(=O)NCCCCC(=O)O |
