YEY
Summary
| Name: | 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrrole |
| Formula: | C12 H11 N O2 |
| Formal charge: | 0 |
| Formula weight: | 201.221 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrrole |
| OpenEye OEToolkits | 2.0.7 | 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1~{H}-pyrrole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1c(ccc2c1OCCO2)c3cccn3 |
| InChI | InChI | 1.03 | InChI=1S/C12H11NO2/c1-2-10(13-5-1)9-3-4-11-12(8-9)15-7-6-14-11/h1-5,8,13H,6-7H2 |
| InChIKey | InChI | 1.03 | DDNMUDQYOUUNRW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C1COc2cc(ccc2O1)c3[nH]ccc3 |
| SMILES | CACTVS | 3.385 | C1COc2cc(ccc2O1)c3[nH]ccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc([nH]c1)c2ccc3c(c2)OCCO3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc([nH]c1)c2ccc3c(c2)OCCO3 |
