C7H
Summary
Name: | 4-(dibenzo[1,2-a:2',1'-d][7]annulen-11-ylidene)-1-methyl-piperidine |
Synonyms: | Cyproheptadine |
Formula: | C21 H21 N |
Formal charge: | 0 |
Formula weight: | 287.398 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 1.9.2 | 4-(dibenzo[1,2-a:2',1'-d][7]annulen-11-ylidene)-1-methyl-piperidine |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C21H21N/c1-22-14-12-18(13-15-22)21-19-8-4-2-6-16(19)10-11-17-7-3-5-9-20(17)21/h2-11H,12-15H2,1H3 |
InChIKey | InChI | 1.03 | JJCFRYNCJDLXIK-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CN1CCC(CC1)=C2c3ccccc3C=Cc4ccccc24 |
SMILES | CACTVS | 3.385 | CN1CCC(CC1)=C2c3ccccc3C=Cc4ccccc24 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CN1CCC(=C2c3ccccc3C=Cc4c2cccc4)CC1 |
SMILES | OpenEye OEToolkits | 1.9.2 | CN1CCC(=C2c3ccccc3C=Cc4c2cccc4)CC1 |