A1CVZ
Summary
| Name: | 1-(7-amino-1H-indol-1-yl)ethan-1-one |
| Formula: | C10 H10 N2 O |
| Formal charge: | 0 |
| Formula weight: | 174.199 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 1-(7-amino-1H-indol-1-yl)ethan-1-one |
| OpenEye OEToolkits | 3.1.0.0 | 1-(7-azanylindol-1-yl)ethanone |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | CC(=O)n1ccc2cccc(N)c21 |
| InChI | InChI | 1.06 | InChI=1S/C10H10N2O/c1-7(13)12-6-5-8-3-2-4-9(11)10(8)12/h2-6H,11H2,1H3 |
| InChIKey | InChI | 1.06 | NEMCRSAEDZCLQC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)n1ccc2cccc(N)c12 |
| SMILES | CACTVS | 3.385 | CC(=O)n1ccc2cccc(N)c12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CC(=O)n1ccc2c1c(ccc2)N |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC(=O)n1ccc2c1c(ccc2)N |
