F5W
Summary
| Name: | 2-propyl-2-azoniatricyclo[7.3.0.0^{3,7}]dodeca-1(9),2,7-trien-8-amine |
| Synonyms: | 2-Propyl-2-azoniatricyclo[7.3.0.03,7]dodeca-1,3(7),8-trien-8-amine |
| Formula: | C14 H21 N2 |
| Formal charge: | 1 |
| Formula weight: | 217.33 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-propyl-2-azoniatricyclo[7.3.0.0^{3,7}]dodeca-1(9),2,7-trien-8-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C14H20N2/c1-2-9-16-12-7-3-5-10(12)14(15)11-6-4-8-13(11)16/h15H,2-9H2,1H3/p+1 |
| InChIKey | InChI | 1.06 | AWNLVKPHFGNVQD-UHFFFAOYSA-O |
| SMILES_CANONICAL | CACTVS | 3.385 | CCC[n+]1c2CCCc2c(N)c3CCCc13 |
| SMILES | CACTVS | 3.385 | CCC[n+]1c2CCCc2c(N)c3CCCc13 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCC[n+]1c2c(c(c3c1CCC3)N)CCC2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCC[n+]1c2c(c(c3c1CCC3)N)CCC2 |
