VEO
Summary
| Name: | 5-methoxy-1H-indole-2-carboxylic acid |
| Formula: | C10 H9 N O3 |
| Formal charge: | 0 |
| Formula weight: | 191.183 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 5-methoxy-1~{H}-indole-2-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C10H9NO3/c1-14-7-2-3-8-6(4-7)5-9(11-8)10(12)13/h2-5,11H,1H3,(H,12,13) |
| InChIKey | InChI | 1.06 | YEBJVSLNUMZXRJ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc2[nH]c(cc2c1)C(O)=O |
| SMILES | CACTVS | 3.385 | COc1ccc2[nH]c(cc2c1)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1ccc2c(c1)cc([nH]2)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc2c(c1)cc([nH]2)C(=O)O |
