LW6
Summary
| Name: | 1H-indole-4-carbaldehyde |
| Formula: | C9 H7 N O |
| Formal charge: | 0 |
| Formula weight: | 145.158 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1H-indole-4-carbaldehyde |
| OpenEye OEToolkits | 2.0.7 | 1~{H}-indole-4-carbaldehyde |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=Cc1cccc2[NH]ccc12 |
| InChI | InChI | 1.06 | InChI=1S/C9H7NO/c11-6-7-2-1-3-9-8(7)4-5-10-9/h1-6,10H |
| InChIKey | InChI | 1.06 | JFDDFGLNZWNJTK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=Cc1cccc2[nH]ccc12 |
| SMILES | CACTVS | 3.385 | O=Cc1cccc2[nH]ccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(c2cc[nH]c2c1)C=O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c2cc[nH]c2c1)C=O |
