C7N
Summary
| Name: | 2-(1-methylpiperidin-4-ylidene)tricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6,9,12,14-heptaen-6-ol |
| Formula: | C21 H21 N O |
| Formal charge: | 0 |
| Formula weight: | 303.398 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 2-(1-methylpiperidin-4-ylidene)tricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6,9,12,14-heptaen-6-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C21H21NO/c1-22-12-10-16(11-13-22)21-19-5-3-2-4-15(19)6-7-17-14-18(23)8-9-20(17)21/h2-9,14,23H,10-13H2,1H3 |
| InChIKey | InChI | 1.03 | SJMZFTTXPYYBAG-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN1CCC(CC1)=C2c3ccccc3C=Cc4cc(O)ccc24 |
| SMILES | CACTVS | 3.385 | CN1CCC(CC1)=C2c3ccccc3C=Cc4cc(O)ccc24 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CN1CCC(=C2c3ccccc3C=Cc4c2ccc(c4)O)CC1 |
| SMILES | OpenEye OEToolkits | 2.0.6 | CN1CCC(=C2c3ccccc3C=Cc4c2ccc(c4)O)CC1 |
