EL
Summary
| Name: | ELLIPTICINE |
| Formula: | C17 H15 N2 |
| Formal charge: | 1 |
| Formula weight: | 247.314 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium |
| OpenEye OEToolkits | 1.5.0 | 5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | c1cccc4c1c2c(c(c3c(c2C)c[nH+]cc3)C)n4 |
| SMILES_CANONICAL | CACTVS | 3.341 | Cc1c2[nH]c3ccccc3c2c(C)c4c[nH+]ccc14 |
| SMILES | CACTVS | 3.341 | Cc1c2[nH]c3ccccc3c2c(C)c4c[nH+]ccc14 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cc1c2cc[nH+]cc2c(c3c1[nH]c4c3cccc4)C |
| SMILES | OpenEye OEToolkits | 1.5.0 | Cc1c2cc[nH+]cc2c(c3c1[nH]c4c3cccc4)C |
| InChI | InChI | 1.03 | InChI=1S/C17H14N2/c1-10-14-9-18-8-7-12(14)11(2)17-16(10)13-5-3-4-6-15(13)19-17/h3-9,19H,1-2H3/p+1 |
| InChIKey | InChI | 1.03 | CTSPAMFJBXKSOY-UHFFFAOYSA-O |
