Clomiphene
2957
Reference
Clomiphene Structure
Systematic / IUPAC Name: 2-{4-[(E)-2-Chloro-1,2-diphenylvinyl]phenoxy}-N,N-diethylethanamine
ID: Reference2957
Other Names:
trans-Clomifene;
trans-Clomiphene;
Clomifene;
Enclomifene;
Enclomiphene
; more
Formula: C26H28ClNO
Class: Therapeutics/Prescription Drugs Sports Doping Drugs
Spectral Data
Clomiphene mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Q Exactive Orbitrap |
| No. of Spectral Trees | 2 |
| No. of Spectra | 238 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI; APCI |
| Analyzers | FT |
| Last Modification | 7/29/2015 2:28:01 PM |
Identificators
| InChI | InChI=1S/C26H28ClNO/c1-3-28(4-2)19-20-29-24-17-15-22(16-18-24)25(21-11-7-5-8-12-21)26(27)23-13-9-6-10-14-23/h5-18H,3-4,19-20H2,1-2H3/b26-25+ |
| InChI Key | GKIRPKYJQBWNGO-OCEACIFDSA-N |
| Canonical SMILES | CCN(CC)CCOC1=CC=C(C=C1)C(=C(C2=CC=CC=C2)Cl)C3=CC=CC=C3 |
| CAS | 911455 |
| Splash | |
| Other Names |
trans-Clomifene; trans-Clomiphene; Clomifene; Enclomifene; Enclomiphene; Transclomifenum; (E)-2-[p-(2-Chloro-1,2-diphenylvinyl)phenoxy]triethylamine ; trans-2-[p-(2-Chloro-1,2-diphenylvinyl)phenoxy]triethylamine ; trans-2-[4-(2-Chloro-1,2-diphenylethenyl)phenoxy]-N,N-diethylethanamine ; 2-[4-(2-Chloro-1,2-diphenylethenyl)phenoxy]-N,N-diethylethanamine; 2-{4-[(E)-2-Chloro-1,2-diphenylethenyl]phenoxy}-N,N-diethylethanamine; Ethanamine, 2-[4-(2-chloro-1,2-diphenylethenyl)phenoxy]-N,N-diethyl, (E)- ; Triethylamine, 2-[p-(2-chloro-1,2-diphenylvinyl)phenoxy], (E)- |