U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C26H29NO.ClH
Molecular Weight 407.976
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of TAMOXIFEN HYDROCHLORIDE

SMILES

Cl.CC\C(C1=CC=CC=C1)=C(/C2=CC=CC=C2)C3=CC=C(OCCN(C)C)C=C3

InChI

InChIKey=FTDBIGNROSSDTJ-OQKDUQJOSA-N
InChI=1S/C26H29NO.ClH/c1-4-25(21-11-7-5-8-12-21)26(22-13-9-6-10-14-22)23-15-17-24(18-16-23)28-20-19-27(2)3;/h5-18H,4,19-20H2,1-3H3;1H/b26-25-;

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C26H29NO
Molecular Weight 371.5146
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:24:11 UTC 2023
Edited
by admin
on Sat Dec 16 18:24:11 UTC 2023
Record UNII
X545Q5UB3E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TAMOXIFEN HYDROCHLORIDE
Common Name English
ETHANAMINE, 2-(4-(1,2-DIPHENYL-1-BUTENYL)PHENOXY)-N,N-DIMETHYL-, HYDROCHLORIDE, (Z)-
Systematic Name English
Code System Code Type Description
PUBCHEM
12543888
Created by admin on Sat Dec 16 18:24:11 UTC 2023 , Edited by admin on Sat Dec 16 18:24:11 UTC 2023
PRIMARY
FDA UNII
X545Q5UB3E
Created by admin on Sat Dec 16 18:24:11 UTC 2023 , Edited by admin on Sat Dec 16 18:24:11 UTC 2023
PRIMARY
CAS
66584-35-8
Created by admin on Sat Dec 16 18:24:11 UTC 2023 , Edited by admin on Sat Dec 16 18:24:11 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY