VAP
Summary
| Name: | 6,7,8-trimethoxy-1,4-dimethylquinolin-2(1H)-one |
| Formula: | C14 H17 N O4 |
| Formal charge: | 0 |
| Formula weight: | 263.289 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 6,7,8-trimethoxy-1,4-dimethylquinolin-2(1H)-one |
| OpenEye OEToolkits | 1.7.0 | 6,7,8-trimethoxy-1,4-dimethyl-quinolin-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C2C=C(c1c(c(OC)c(OC)c(OC)c1)N2C)C |
| SMILES_CANONICAL | CACTVS | 3.370 | COc1cc2C(=CC(=O)N(C)c2c(OC)c1OC)C |
| SMILES | CACTVS | 3.370 | COc1cc2C(=CC(=O)N(C)c2c(OC)c1OC)C |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | CC1=CC(=O)N(c2c1cc(c(c2OC)OC)OC)C |
| SMILES | OpenEye OEToolkits | 1.7.0 | CC1=CC(=O)N(c2c1cc(c(c2OC)OC)OC)C |
| InChI | InChI | 1.03 | InChI=1S/C14H17NO4/c1-8-6-11(16)15(2)12-9(8)7-10(17-3)13(18-4)14(12)19-5/h6-7H,1-5H3 |
| InChIKey | InChI | 1.03 | QKOJIFYKROBOKN-UHFFFAOYSA-N |
