(3E)-7-tert-butyl-5-methyl-3-[(2,4,6-trimethylphenyl)methylidene]-2H-1,3-benzoxazol-3-ium

Systemtic Name: (3E)-7-tert-butyl-5-methyl-3-[(2,4,6-trimethylphenyl)methylidene]-2H-1,3-benzoxazol-3-ium Openeye Name: (3E)-7-tert-butyl-5-methyl-3-[(2,4,6-trimethylphenyl)methylene]-2H-1,3-benzoxazol-3-ium CAS Name: (3E)-7-tert-butyl-5-methyl-3-[(2,4,6-trimethylphenyl)methylidene]-2H-1,3-benzoxazol-3-ium IUPAC Name: (3E)-7-tert-butyl-5-methyl-3-[(2,4,6-trimethylphenyl)methylidene]-2H-1,3-benzoxazol-3-ium Traditional Name: (3E)-7-tert-butyl-5-methyl-3-(2,4,6-trimethylbenzylidene)-2H-1,3-benzoxazol-3-ium Formula: C22H28NO+ MolecularWeight: 322.46382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C=[N+]2COC3=C(C=C(C=C32)C)C(C)(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)/C=[N+]\2/COC3=C(C=C(C=C32)C)C(C)(C)C)C

InChI

InChI=1S/C22H28NO/c1-14-8-16(3)18(17(4)9-14)12-23-13-24-21-19(22(5,6)7)10-15(2)11-20(21)23/h8-12H,13H2,1-7H3/q+1/b23-12-