(+/-)-trans-N-methyl-N-[2-(1-hexahydroazepinyl)cyclohexyl](3,4-dichlorophenoxy)acetamide monohydrochloride

HCID 67685166
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Basic information

Standard SMILES
CN(C(=O)COc1ccc(Cl)c(Cl)c1)[C@@H]1CCCC[C@H]1N1CCCCCC1.Cl
InChIKey
MVUPZEIBKNPXDX-GZJHNZOKSA-N
Molecular formula
C21H31Cl3N2O2
Average molar mass
449.8 g/mol

Names & identifiers

Preferred name
(+/-)-trans-N-methyl-N-[2-(1-hexahydroazepinyl)cyclohexyl](3,4-dichlorophenoxy)acetamide monohydrochloride
IUPAC
N-[(1R,2R)-2-(azepan-1-yl)cyclohexyl]-2-(3,4-dichlorophenoxy)-N-methylacetamide;hydrochloride

Names & synonyms

SCHEMBL8763802MVUPZEIBKNPXDX-GZJHNZOKSA-N(+/-)-trans-N-methyl-N-[2-(1-hexahydroazepinyl)cyclohexyl](3,4-dichlorophenoxy)acetamide monohydrochloride

Database identifiers

PubChem CID
67685166

Properties

Computed structural properties

Topological polar surface area
32.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
28

Related reactions

1 records
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Compound notes

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