VVV
Summary
| Name: | 5,6,8-trimethoxy-4-methylquinolin-2(1H)-one |
| Formula: | C13 H15 N O4 |
| Formal charge: | 0 |
| Formula weight: | 249.262 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 5,6,8-trimethoxy-4-methylquinolin-2(1H)-one |
| OpenEye OEToolkits | 1.7.0 | 5,6,8-trimethoxy-4-methyl-1H-quinolin-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C2C=C(c1c(OC)c(OC)cc(OC)c1N2)C |
| SMILES_CANONICAL | CACTVS | 3.370 | COc1cc(OC)c(OC)c2C(=CC(=O)Nc12)C |
| SMILES | CACTVS | 3.370 | COc1cc(OC)c(OC)c2C(=CC(=O)Nc12)C |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | CC1=CC(=O)Nc2c1c(c(cc2OC)OC)OC |
| SMILES | OpenEye OEToolkits | 1.7.0 | CC1=CC(=O)Nc2c1c(c(cc2OC)OC)OC |
| InChI | InChI | 1.03 | InChI=1S/C13H15NO4/c1-7-5-10(15)14-12-8(16-2)6-9(17-3)13(18-4)11(7)12/h5-6H,1-4H3,(H,14,15) |
| InChIKey | InChI | 1.03 | YRUICGVVPDTGCH-UHFFFAOYSA-N |
