LBI
Summary
| Name: | 4-methoxy-1H-indole-2-carbaldehyde |
| Formula: | C10 H9 N O2 |
| Formal charge: | 0 |
| Formula weight: | 175.184 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-methoxy-1H-indole-2-carbaldehyde |
| OpenEye OEToolkits | 2.0.7 | 4-methoxy-1~{H}-indole-2-carbaldehyde |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | COc1cccc2[NH]c(cc21)C=O |
| InChI | InChI | 1.03 | InChI=1S/C10H9NO2/c1-13-10-4-2-3-9-8(10)5-7(6-12)11-9/h2-6,11H,1H3 |
| InChIKey | InChI | 1.03 | BMUMJEKBMVREKT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cccc2[nH]c(C=O)cc12 |
| SMILES | CACTVS | 3.385 | COc1cccc2[nH]c(C=O)cc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1cccc2c1cc([nH]2)C=O |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1cccc2c1cc([nH]2)C=O |
