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

Systemtic Name: (3E)-7-tert-butyl-3-[(2,5-dimethylphenyl)methylidene]-5-methyl-2H-1,3-benzoxazol-3-ium Openeye Name: (3E)-7-tert-butyl-3-[(2,5-dimethylphenyl)methylene]-5-methyl-2H-1,3-benzoxazol-3-ium CAS Name: (3E)-7-tert-butyl-3-[(2,5-dimethylphenyl)methylidene]-5-methyl-2H-1,3-benzoxazol-3-ium IUPAC Name: (3E)-7-tert-butyl-3-[(2,5-dimethylphenyl)methylidene]-5-methyl-2H-1,3-benzoxazol-3-ium Traditional Name: (3E)-7-tert-butyl-3-(2,5-dimethylbenzylidene)-5-methyl-2H-1,3-benzoxazol-3-ium Formula: C21H26NO+ MolecularWeight: 308.43724

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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

Isomeric SMILES

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

InChI

InChI=1S/C21H26NO/c1-14-7-8-16(3)17(9-14)12-22-13-23-20-18(21(4,5)6)10-15(2)11-19(20)22/h7-12H,13H2,1-6H3/q+1/b22-12-