F2Z
Summary
| Name: | 6,7-dimethoxy-2,4-dihydro-1~{H}-isoquinolin-3-one |
| Formula: | C11 H13 N O3 |
| Formal charge: | 0 |
| Formula weight: | 207.226 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 6,7-dimethoxy-2,4-dihydro-1~{H}-isoquinolin-3-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C11H13NO3/c1-14-9-3-7-5-11(13)12-6-8(7)4-10(9)15-2/h3-4H,5-6H2,1-2H3,(H,12,13) |
| InChIKey | InChI | 1.03 | FRBTVJSVXIIDIG-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cc2CNC(=O)Cc2cc1OC |
| SMILES | CACTVS | 3.385 | COc1cc2CNC(=O)Cc2cc1OC |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | COc1cc2c(cc1OC)CNC(=O)C2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | COc1cc2c(cc1OC)CNC(=O)C2 |
