2-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]ethyl-dimethyl-azanium chloride

Systemtic Name: 2-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]ethyl-dimethyl-azanium chloride Openeye Name: 2-[3-(4-chlorophenyl)isoxazol-5-yl]ethyl-dimethyl-ammonium chloride CAS Name: 2-[3-(4-chlorophenyl)-5-isoxazolyl]ethyl-dimethylammonium chloride IUPAC Name: 2-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]ethyl-dimethylazanium chloride Traditional Name: 2-[3-(4-chlorophenyl)isoxazol-5-yl]ethyl-dimethyl-ammonium chloride Formula: C13H16Cl2N2O MolecularWeight: 287.18494

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC1=CC(=NO1)C2=CC=C(C=C2)Cl.[Cl-]

Isomeric SMILES

C[NH+](C)CCC1=CC(=NO1)C2=CC=C(C=C2)Cl.[Cl-]

InChI

InChI=1S/C13H15ClN2O.ClH/c1-16(2)8-7-12-9-13(15-17-12)10-3-5-11(14)6-4-10;/h3-6,9H,7-8H2,1-2H3;1H