Obsolete: TNP
Summary
| Name: | 3,5,6,8-TETRAMETHYL-N-METHYL PHENANTHROLINIUM |
| Formula: | C17 H19 N2 |
| Formal charge: | 1 |
| Formula weight: | 251.346 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1,3,5,6,8-pentamethyl-1,10-phenanthrolin-1-ium |
| OpenEye OEToolkits | 1.7.6 | 1,3,5,6,8-pentamethyl-1,10-phenanthrolin-1-ium |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n2cc(cc3c(c(c1cc(c[n+](c1c23)C)C)C)C)C |
| InChI | InChI | 1.03 | InChI=1S/C17H19N2/c1-10-6-14-12(3)13(4)15-7-11(2)9-19(5)17(15)16(14)18-8-10/h6-9H,1-5H3/q+1 |
| InChIKey | InChI | 1.03 | FQTUZNACZKILMC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | Cc1cnc2c(c1)c(C)c(C)c3cc(C)c[n+](C)c23 |
| SMILES | CACTVS | 3.370 | Cc1cnc2c(c1)c(C)c(C)c3cc(C)c[n+](C)c23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | Cc1cc2c(c(c3cc(c[n+](c3c2nc1)C)C)C)C |
| SMILES | OpenEye OEToolkits | 1.7.6 | Cc1cc2c(c(c3cc(c[n+](c3c2nc1)C)C)C)C |
