3-phenyl-5-(1-piperidin-1-ium-1-ylethyl)-1,2-oxazole chloride

Systemtic Name: 3-phenyl-5-(1-piperidin-1-ium-1-ylethyl)-1,2-oxazole chloride Openeye Name: 3-phenyl-5-(1-piperidin-1-ium-1-ylethyl)isoxazole chloride CAS Name: 3-phenyl-5-[1-(1-piperidin-1-iumyl)ethyl]isoxazole chloride IUPAC Name: 3-phenyl-5-(1-piperidin-1-ium-1-ylethyl)-1,2-oxazole chloride Traditional Name: 3-phenyl-5-(1-piperidin-1-ium-1-ylethyl)isoxazole chloride Formula: C16H21ClN2O MolecularWeight: 292.80374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=NO1)C2=CC=CC=C2)[NH+]3CCCCC3.[Cl-]

Isomeric SMILES

CC(C1=CC(=NO1)C2=CC=CC=C2)[NH+]3CCCCC3.[Cl-]

InChI

InChI=1S/C16H20N2O.ClH/c1-13(18-10-6-3-7-11-18)16-12-15(17-19-16)14-8-4-2-5-9-14;/h2,4-5,8-9,12-13H,3,6-7,10-11H2,1H3;1H