M3F
Summary
| Name: | 1-methyl-3-(trifluoromethyl)benzo[c][1,8]naphthyridin-6(5H)-one |
| Formula: | C14 H9 F3 N2 O |
| Formal charge: | 0 |
| Formula weight: | 278.229 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-methyl-3-(trifluoromethyl)benzo[c][1,8]naphthyridin-6(5H)-one |
| OpenEye OEToolkits | 1.7.0 | 1-methyl-3-(trifluoromethyl)-5H-benzo[c][1,8]naphthyridin-6-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | FC(F)(F)c3nc1c(c2c(C(=O)N1)cccc2)c(c3)C |
| SMILES_CANONICAL | CACTVS | 3.370 | Cc1cc(nc2NC(=O)c3ccccc3c12)C(F)(F)F |
| SMILES | CACTVS | 3.370 | Cc1cc(nc2NC(=O)c3ccccc3c12)C(F)(F)F |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | Cc1cc(nc2c1-c3ccccc3C(=O)N2)C(F)(F)F |
| SMILES | OpenEye OEToolkits | 1.7.0 | Cc1cc(nc2c1-c3ccccc3C(=O)N2)C(F)(F)F |
| InChI | InChI | 1.03 | InChI=1S/C14H9F3N2O/c1-7-6-10(14(15,16)17)18-12-11(7)8-4-2-3-5-9(8)13(20)19-12/h2-6H,1H3,(H,18,19,20) |
| InChIKey | InChI | 1.03 | DRKNNRNHSWAINH-UHFFFAOYSA-N |
