Basic information
- CAS
38085-10-8- Standard SMILES
COc1cc(CC2NCCc3cc(O)ccc32)cc(OC)c1OC.Cl- InChIKey
HTLHJNVXKYJRTH-UHFFFAOYSA-N- Molecular formula
- C19H24ClNO4
- Average molar mass
- 365.8 g/mol
- Monoisotopic mass
- 365.1393859
Names & identifiers
- Preferred name
- 6-Isoquinolinol, 1,2,3,4-tetrahydro-1-((3,4,5-trimethoxyphenyl)methyl)-, hydrochloride
- IUPAC
- 1-[(3,4,5-trimethoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-6-ol;hydrochloride
Names & synonyms
38085-10-86-Isoquinolinol, 1,2,3,4-tetrahydro-1-((3,4,5-trimethoxyphenyl)methyl)-, hydrochlorideRefChem:10740091-(3,4,5-Trimethoxybenzyl)-6-hydroxy-1,2,3,4-tetrahydroisoquinoline hydrochloride1-[(3,4,5-trimethoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-6-ol;hydrochlorideCV 7051,2,3,4-Tetrahydro-1-((3,4,5-trimethoxyphenyl)methyl)-6-isoquinolinol hydrochlorideDTXSID801356513NSC3104041-[(3,4,5-trimethoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-6-olNSC 310404NSC-310404
Show more names
DS-0085091-(3,4,5-Trimethoxybenzyl)-1,2,3,4-tetrahydro-6-isoquinolinol hydrochloride (1:1)
Database identifiers
- CAS
38085-10-8- PubChem CID
- 217067
- DTXSID
DTXSID801356513
Properties
Computed structural properties
- Topological polar surface area
- 60 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 380
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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