3-[[2-[4-(3-ethoxyphenyl)butyl]phenoxy]methyl]piperidin-1-ium chloride

Systemtic Name: 3-[[2-[4-(3-ethoxyphenyl)butyl]phenoxy]methyl]piperidin-1-ium chloride Openeye Name: 3-[[2-[4-(3-ethoxyphenyl)butyl]phenoxy]methyl]piperidin-1-ium chloride CAS Name: 3-[[2-[4-(3-ethoxyphenyl)butyl]phenoxy]methyl]piperidin-1-ium chloride IUPAC Name: 3-[[2-[4-(3-ethoxyphenyl)butyl]phenoxy]methyl]piperidin-1-ium chloride Traditional Name: 3-[[2-(4-m-phenetylbutyl)phenoxy]methyl]piperidin-1-ium chloride Formula: C24H34ClNO2 MolecularWeight: 403.98526

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)CCCCC2=CC=CC=C2OCC3CCC[NH2+]C3.[Cl-]

Isomeric SMILES

CCOC1=CC=CC(=C1)CCCCC2=CC=CC=C2OCC3CCC[NH2+]C3.[Cl-]

InChI

InChI=1S/C24H33NO2.ClH/c1-2-26-23-14-7-10-20(17-23)9-3-4-12-22-13-5-6-15-24(22)27-19-21-11-8-16-25-18-21;/h5-7,10,13-15,17,21,25H,2-4,8-9,11-12,16,18-19H2,1H3;1H