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Details

Stereochemistry ACHIRAL
Molecular Formula C20H25NO.ClH
Molecular Weight 331.88
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AMITRIPTYNOL HYDROCHLORIDE

SMILES

Cl.CN(C)CCCC1(O)C2=CC=CC=C2CCC3=CC=CC=C13

InChI

InChIKey=XHURLEYPZGLDQG-UHFFFAOYSA-N
InChI=1S/C20H25NO.ClH/c1-21(2)15-7-14-20(22)18-10-5-3-8-16(18)12-13-17-9-4-6-11-19(17)20;/h3-6,8-11,22H,7,12-15H2,1-2H3;1H

HIDE SMILES / InChI

Molecular Formula C20H25NO
Molecular Weight 295.4186
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

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

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:49:00 GMT 2023
Edited
by admin
on Sat Dec 16 12:49:00 GMT 2023
Record UNII
U9Z44LS37X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AMITRIPTYNOL HYDROCHLORIDE
Common Name English
5H-Dibenzo[a,d]cyclohepten-5-ol, 5-[3-(dimethylamino)propyl]-10,11-dihydro-, hydrochloride (1:1)
Systematic Name English
11-[3-(dimethylamino)propyl]-5,6-dihydrodibenzo[1,2-a:1',2'-e][7]annulen-11-ol,hydrochloride
Systematic Name English
NSC-269607
Code English
5H-DIBENZO(A,D)CYCLOHEPTEN-5-OL, 10,11-DIHYDRO-5-(3-(DIMETHYLAMINO)PROPYL)-, MONOHYDROCHLORIDE
Common Name English
Code System Code Type Description
CAS
2754-55-4
Created by admin on Sat Dec 16 12:49:00 GMT 2023 , Edited by admin on Sat Dec 16 12:49:00 GMT 2023
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PUBCHEM
17684
Created by admin on Sat Dec 16 12:49:00 GMT 2023 , Edited by admin on Sat Dec 16 12:49:00 GMT 2023
PRIMARY
NSC
269607
Created by admin on Sat Dec 16 12:49:00 GMT 2023 , Edited by admin on Sat Dec 16 12:49:00 GMT 2023
PRIMARY
FDA UNII
U9Z44LS37X
Created by admin on Sat Dec 16 12:49:00 GMT 2023 , Edited by admin on Sat Dec 16 12:49:00 GMT 2023
PRIMARY
EPA CompTox
DTXSID00950218
Created by admin on Sat Dec 16 12:49:00 GMT 2023 , Edited by admin on Sat Dec 16 12:49:00 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE