1-(2-Chlorophenoxy)-4-(1,2,3,4-tetrahydroisoquinolyl)-2-butanol Hydrochloride Hydrate

HCID 21274581
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Basic information

Standard SMILES
Cl.O.OC(CCC1NCCc2ccccc21)COc1ccccc1Cl
InChIKey
OMDMWHPWJFLPNJ-UHFFFAOYSA-N
Molecular formula
C19H25Cl2NO3
Average molar mass
386.3 g/mol

Names & identifiers

Preferred name
1-(2-Chlorophenoxy)-4-(1,2,3,4-tetrahydroisoquinolyl)-2-butanol Hydrochloride Hydrate
IUPAC
1-(2-chlorophenoxy)-4-(1,2,3,4-tetrahydroisoquinolin-1-yl)butan-2-ol;hydrate;hydrochloride

Names & synonyms

SCHEMBL10544569OMDMWHPWJFLPNJ-UHFFFAOYSA-N1-(2-Chlorophenoxy)-4-(1,2,3,4-tetrahydroisoquinolyl)-2-butanol Hydrochloride Hydrate

Database identifiers

PubChem CID
21274581

Properties

Computed structural properties

Topological polar surface area
42.5 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
25

Related reactions

5 records
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Linked notes

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