3-(4-chlorophenyl)-5-(piperidin-1-ium-1-ylmethyl)-1,2-oxazole chloride

Systemtic Name: 3-(4-chlorophenyl)-5-(piperidin-1-ium-1-ylmethyl)-1,2-oxazole chloride Openeye Name: 3-(4-chlorophenyl)-5-(piperidin-1-ium-1-ylmethyl)isoxazole chloride CAS Name: 3-(4-chlorophenyl)-5-(1-piperidin-1-iumylmethyl)isoxazole chloride IUPAC Name: 3-(4-chlorophenyl)-5-(piperidin-1-ium-1-ylmethyl)-1,2-oxazole chloride Traditional Name: 3-(4-chlorophenyl)-5-(piperidin-1-ium-1-ylmethyl)isoxazole chloride Formula: C15H18Cl2N2O MolecularWeight: 313.22222

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC(=NO2)C3=CC=C(C=C3)Cl.[Cl-]

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC(=NO2)C3=CC=C(C=C3)Cl.[Cl-]

InChI

InChI=1S/C15H17ClN2O.ClH/c16-13-6-4-12(5-7-13)15-10-14(19-17-15)11-18-8-2-1-3-9-18;/h4-7,10H,1-3,8-9,11H2;1H