7AN
Summary
| Name: | ~{N}-[2-(1~{H}-indol-3-yl)ethyl]ethanamide |
| Synonyms: | N-acetyltryptamine |
| Formula: | C12 H14 N2 O |
| Formal charge: | 0 |
| Formula weight: | 202.252 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.5 | ~{N}-[2-(1~{H}-indol-3-yl)ethyl]ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C12H14N2O/c1-9(15)13-7-6-10-8-14-12-5-3-2-4-11(10)12/h2-5,8,14H,6-7H2,1H3,(H,13,15) |
| InChIKey | InChI | 1.03 | NVUGEQAEQJTCIX-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)NCCc1c[nH]c2ccccc12 |
| SMILES | CACTVS | 3.385 | CC(=O)NCCc1c[nH]c2ccccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | CC(=O)NCCc1c[nH]c2c1cccc2 |
| SMILES | OpenEye OEToolkits | 2.0.5 | CC(=O)NCCc1c[nH]c2c1cccc2 |
