WOQ
Summary
| Name: | Setiptiline |
| Synonyms: | [4a(13b)M,13aM]-2-methyl-2,3,4,9-tetrahydro-1H-dibenzo[3,4:6,7]cyclohepta[1,2-c]pyridine Tecipul; delta(13b,4a),4a-Carba-mianserin; MO-8282; ORG-8282 |
| Formula: | C19 H19 N |
| Formal charge: | 0 |
| Formula weight: | 261.361 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | [4a(13b)M,13aM]-2-methyl-2,3,4,9-tetrahydro-1H-dibenzo[3,4:6,7]cyclohepta[1,2-c]pyridine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | CN1CC2=C(CC1)c1ccccc1Cc1ccccc21 |
| InChI | InChI | 1.06 | InChI=1S/C19H19N/c1-20-11-10-18-16-8-4-2-6-14(16)12-15-7-3-5-9-17(15)19(18)13-20/h2-9H,10-13H2,1H3 |
| InChIKey | InChI | 1.06 | GVPIXRLYKVFFMK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN1CCC2=C(C1)c3ccccc3Cc4ccccc24 |
| SMILES | CACTVS | 3.385 | CN1CCC2=C(C1)c3ccccc3Cc4ccccc24 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN1CCC2=C(C1)c3ccccc3Cc4c2cccc4 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CN1CCC2=C(C1)c3ccccc3Cc4c2cccc4 |
