1-[2-(2,3-dihydro-1,4-benzodioxin-5-yloxy)ethyl]azepan-1-ium chloride

Systemtic Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-5-yloxy)ethyl]azepan-1-ium chloride Openeye Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-5-yloxy)ethyl]azepan-1-ium chloride CAS Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-5-yloxy)ethyl]azepan-1-ium chloride IUPAC Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-5-yloxy)ethyl]azepan-1-ium chloride Traditional Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-5-yloxy)ethyl]azepan-1-ium chloride Formula: C16H24ClNO3 MolecularWeight: 313.81966

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CCOC2=CC=CC3=C2OCCO3.[Cl-]

Isomeric SMILES

C1CCC[NH+](CC1)CCOC2=CC=CC3=C2OCCO3.[Cl-]

InChI

InChI=1S/C16H23NO3.ClH/c1-2-4-9-17(8-3-1)10-11-18-14-6-5-7-15-16(14)20-13-12-19-15;/h5-7H,1-4,8-13H2;1H