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

Systemtic Name: (3E)-7-tert-butyl-3-[(4-fluorophenyl)methylidene]-5-methyl-2H-1,3-benzoxazol-3-ium Openeye Name: (3E)-7-tert-butyl-3-[(4-fluorophenyl)methylene]-5-methyl-2H-1,3-benzoxazol-3-ium CAS Name: (3E)-7-tert-butyl-3-[(4-fluorophenyl)methylidene]-5-methyl-2H-1,3-benzoxazol-3-ium IUPAC Name: (3E)-7-tert-butyl-3-[(4-fluorophenyl)methylidene]-5-methyl-2H-1,3-benzoxazol-3-ium Traditional Name: (3E)-7-tert-butyl-3-(4-fluorobenzylidene)-5-methyl-2H-1,3-benzoxazol-3-ium Formula: C19H21FNO+ MolecularWeight: 298.374543

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21FNO/c1-13-9-16(19(2,3)4)18-17(10-13)21(12-22-18)11-14-5-7-15(20)8-6-14/h5-11H,12H2,1-4H3/q+1/b21-11-