2-(4-chlorophenyl)-3-methyl-4,5-dihydro-1,3-oxazol-3-ium; tris(fluoranyl)methanesulfonate

Systemtic Name: 2-(4-chlorophenyl)-3-methyl-4,5-dihydro-1,3-oxazol-3-ium; tris(fluoranyl)methanesulfonate Openeye Name: 2-(4-chlorophenyl)-3-methyl-4,5-dihydrooxazol-3-ium; trifluoromethanesulfonate CAS Name: 2-(4-chlorophenyl)-3-methyl-4,5-dihydrooxazol-3-ium; trifluoromethanesulfonate IUPAC Name: 2-(4-chlorophenyl)-3-methyl-4,5-dihydro-1,3-oxazol-3-ium; trifluoromethanesulfonate Traditional Name: 2-(4-chlorophenyl)-3-methyl-2-oxazolin-3-ium triflate Formula: C11H11ClF3NO4S MolecularWeight: 345.72255

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(OCC1)C2=CC=C(C=C2)Cl.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C[N+]1=C(OCC1)C2=CC=C(C=C2)Cl.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C10H11ClNO.CHF3O3S/c1-12-6-7-13-10(12)8-2-4-9(11)5-3-8;2-1(3,4)8(5,6)7/h2-5H,6-7H2,1H3;(H,5,6,7)/q+1;/p-1