Basic information
- CAS
3589-31-9- Standard SMILES
C[NH+](C)CCCC1c2ccccc2CCc2ccc(Cl)cc21.[Cl-]- InChIKey
CLZDRXDNLNORQJ-UHFFFAOYSA-N- Molecular formula
- C20H25Cl2N
- Average molar mass
- 350.3 g/mol
- Monoisotopic mass
- 349.1364052
Names & identifiers
- Preferred name
- Chloramitriptyline hydrochloride
- IUPAC
- 3-(5-chloro-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)propyl-dimethylazanium chloride
Names & synonyms
L 572451 hydrochlorideChloramitriptyline hydrochlorideVUFB31023-Chloro-N,N-dimethyl-10,11-dihydro-5H-dibenzo(a,d)cycloheptene-5-propylamine hydrochloride5H-Dibenzo(a,d)cycloheptene-5-propylamine, 3-chloro-10,11-dihydro-N,N-dimethyl-, HCl3589-31-95H-Dibenzo(a,d)cycloheptene-5-propylamine, 10,11-dihydro-3-chloro-N,N-dimethyl-, monohydrochlorideRefChem:333659
Database identifiers
- CAS
3589-31-9- PubChem CID
- 19170
Properties
Computed structural properties
- Topological polar surface area
- 4.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 343
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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