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1-[3-butoxy-5-(piperidin-1-ium-1-ylmethyl)phenyl]ethanone chloride

1-[3-butoxy-5-(piperidin-1-ium-1-ylmethyl)phenyl]ethanone chloride

Systemtic Name:1-[3-butoxy-5-(piperidin-1-ium-1-ylmethyl)phenyl]ethanone chloride
Openeye Name:1-[3-butoxy-5-(piperidin-1-ium-1-ylmethyl)phenyl]ethanone chloride
CAS Name:1-[3-butoxy-5-(1-piperidin-1-iumylmethyl)phenyl]ethanone chloride
IUPAC Name:1-[3-butoxy-5-(piperidin-1-ium-1-ylmethyl)phenyl]ethanone chloride
Traditional Name:1-[3-butoxy-5-(piperidin-1-ium-1-ylmethyl)phenyl]ethanone chloride
Formula: C18H28ClNO2
MolecularWeight: 325.87342
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=CC(=C1)C[NH+]2CCCCC2)C(=O)C.[Cl-]


Isomeric SMILES

CCCCOC1=CC(=CC(=C1)C[NH+]2CCCCC2)C(=O)C.[Cl-]


InChI

InChI=1S/C18H27NO2.ClH/c1-3-4-10-21-18-12-16(11-17(13-18)15(2)20)14-19-8-6-5-7-9-19;/h11-13H,3-10,14H2,1-2H3;1H


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