A1JUV
Summary
| Name: | 3-but-3-enoxy-1~{H}-quinolin-2-one |
| Formula: | C13 H13 N O2 |
| Formal charge: | 0 |
| Formula weight: | 215.248 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 3-but-3-enoxy-1~{H}-quinolin-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C13H13NO2/c1-2-3-8-16-12-9-10-6-4-5-7-11(10)14-13(12)15/h2,4-7,9H,1,3,8H2,(H,14,15) |
| InChIKey | InChI | 1.06 | UXVYMABGLCMKCH-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C=CCCOC1=Cc2ccccc2NC1=O |
| SMILES | CACTVS | 3.385 | C=CCCOC1=Cc2ccccc2NC1=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C=CCCOC1=Cc2ccccc2NC1=O |
| SMILES | OpenEye OEToolkits | 2.0.7 | C=CCCOC1=Cc2ccccc2NC1=O |
