2-(2-chloranyl-3-fluoranyl-phenyl)-3,4,4-trimethyl-5H-1,3-oxazol-3-ium

Systemtic Name: 2-(2-chloranyl-3-fluoranyl-phenyl)-3,4,4-trimethyl-5H-1,3-oxazol-3-ium Openeye Name: 2-(2-chloro-3-fluoro-phenyl)-3,4,4-trimethyl-5H-oxazol-3-ium CAS Name: 2-(2-chloro-3-fluorophenyl)-3,4,4-trimethyl-5H-oxazol-3-ium IUPAC Name: 2-(2-chloro-3-fluorophenyl)-3,4,4-trimethyl-5H-1,3-oxazol-3-ium Traditional Name: 2-(2-chloro-3-fluoro-phenyl)-3,4,4-trimethyl-2-oxazolin-3-ium Formula: C12H14ClFNO+ MolecularWeight: 242.697063

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(=[N+]1C)C2=C(C(=CC=C2)F)Cl)C

Isomeric SMILES

CC1(COC(=[N+]1C)C2=C(C(=CC=C2)F)Cl)C

InChI

InChI=1S/C12H14ClFNO/c1-12(2)7-16-11(15(12)3)8-5-4-6-9(14)10(8)13/h4-6H,7H2,1-3H3/q+1