Amitriptyline

Synonyms: amitriptyline, "Amitriptylin", "Elavil", "Damitriptyline", "Triptanol", "Seroten", "Damilen", "Lantron", "Flavyl", "Proheptadiene", "Triptisol", "Tryptanol", "Adepress", "Adepril", "Amitriprolidine", "Amitryptiline", "Triptilin", "Redomex", "Amytriptylin", "Amitriptilina", "Amitriptylinum", "Damilan", "Laroxyl", "Amitryptyline", "Amytriptiline", "Amitril", "Laroxil", "Sarotex", "Elanil", "Endep", "MK 230"

Source: Amitriptyline?is?an?antidepressant and and effective drug for the treatment of chronic pain.

Identifiers:

IUPAC Name: N,N-dimethyl-3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylidene)propan-1-amine
CAS Number: 50-48-6
PubChem ID: 2160
InChiKey: KRMDCWKBEZIMAB-UHFFFAOYSA-N
Canonical SMILES: CN(C)CCC=C1C2=CC=CC=C2CCC3=CC=CC=C31

Structural Properties:

Molecular Formula: C₂₀H₂₃N
Molecular Weight: 277,400

Pharmacophore Features:

Number of bond donors: 0
Number of bond acceptors: 1
Number of atoms different from hydrogen: 21

Downloads

2D structure (.sdf)
3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
3D structure (.pdbqt)

Search Similar molecules

Evidence Supporting This Chemical as an Emerging Contaminant

Alidina, M., Hoppe-Jones, C., Yoon, M., Hamadeh, A. F., Li, D., & Drewes, J. E. (2014). The occurrence of emerging trace organic chemicals in wastewater effluents in Saudi Arabia. Science of the Total Environment, 478, 152-162.

External Links

PubChem

PubMed (general search)

PubMed (search as emerging contaminant)

2D-structure

3D-structure