VZK
Summary
| Name: | ~{N},~{N}-dimethyl-6-[(~{E})-2-(1-methylpyridin-1-ium-4-yl)ethenyl]naphthalen-2-amine |
| Formula: | C20 H21 N2 |
| Formal charge: | 1 |
| Formula weight: | 289.394 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N},~{N}-dimethyl-6-[(~{E})-2-(1-methylpyridin-1-ium-4-yl)ethenyl]naphthalen-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C20H21N2/c1-21(2)20-9-8-18-14-17(6-7-19(18)15-20)5-4-16-10-12-22(3)13-11-16/h4-15H,1-3H3/q+1 |
| InChIKey | InChI | 1.06 | LJEHGRUCASFWGC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(C)c1ccc2cc(\C=C\c3cc[n+](C)cc3)ccc2c1 |
| SMILES | CACTVS | 3.385 | CN(C)c1ccc2cc(C=Cc3cc[n+](C)cc3)ccc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C[n+]1ccc(cc1)/C=C/c2ccc3cc(ccc3c2)N(C)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | C[n+]1ccc(cc1)C=Cc2ccc3cc(ccc3c2)N(C)C |
