(3E)-3-[(4-fluorophenyl)methylidene]-5,7-dimethyl-2H-1,3-benzoxazol-3-ium

Systemtic Name: (3E)-3-[(4-fluorophenyl)methylidene]-5,7-dimethyl-2H-1,3-benzoxazol-3-ium Openeye Name: (3E)-3-[(4-fluorophenyl)methylene]-5,7-dimethyl-2H-1,3-benzoxazol-3-ium CAS Name: (3E)-3-[(4-fluorophenyl)methylidene]-5,7-dimethyl-2H-1,3-benzoxazol-3-ium IUPAC Name: (3E)-3-[(4-fluorophenyl)methylidene]-5,7-dimethyl-2H-1,3-benzoxazol-3-ium Traditional Name: (3E)-3-(4-fluorobenzylidene)-5,7-dimethyl-2H-1,3-benzoxazol-3-ium Formula: C16H15FNO+ MolecularWeight: 256.294803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)[N+](=CC3=CC=C(C=C3)F)CO2)C

Isomeric SMILES

CC1=CC(=C2C(=C1)/[N+](=C\C3=CC=C(C=C3)F)/CO2)C

InChI

InChI=1S/C16H15FNO/c1-11-7-12(2)16-15(8-11)18(10-19-16)9-13-3-5-14(17)6-4-13/h3-9H,10H2,1-2H3/q+1/b18-9-