V9X
Summary
| Name: | 3-(1H-indol-3-yl)propanamide |
| Formula: | C11 H12 N2 O |
| Formal charge: | 0 |
| Formula weight: | 188.226 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-(1H-indol-3-yl)propanamide |
| OpenEye OEToolkits | 2.0.7 | 3-(1~{H}-indol-3-yl)propanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | NC(=O)CCc1c[NH]c2ccccc21 |
| InChI | InChI | 1.06 | InChI=1S/C11H12N2O/c12-11(14)6-5-8-7-13-10-4-2-1-3-9(8)10/h1-4,7,13H,5-6H2,(H2,12,14) |
| InChIKey | InChI | 1.06 | OTVHXWFANORBAK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)CCc1c[nH]c2ccccc12 |
| SMILES | CACTVS | 3.385 | NC(=O)CCc1c[nH]c2ccccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)c(c[nH]2)CCC(=O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)c(c[nH]2)CCC(=O)N |
