(3E)-7-tert-butyl-3-(2,2-dimethylpropylidene)-5-methyl-2H-1,3-benzoxazol-3-ium

Systemtic Name: (3E)-7-tert-butyl-3-(2,2-dimethylpropylidene)-5-methyl-2H-1,3-benzoxazol-3-ium Openeye Name: (3E)-7-tert-butyl-3-(2,2-dimethylpropylidene)-5-methyl-2H-1,3-benzoxazol-3-ium CAS Name: (3E)-7-tert-butyl-3-(2,2-dimethylpropylidene)-5-methyl-2H-1,3-benzoxazol-3-ium IUPAC Name: (3E)-7-tert-butyl-3-(2,2-dimethylpropylidene)-5-methyl-2H-1,3-benzoxazol-3-ium Traditional Name: (3E)-7-tert-butyl-5-methyl-3-neopentylidene-2H-1,3-benzoxazol-3-ium Formula: C17H26NO+ MolecularWeight: 260.39444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26NO/c1-12-8-13(17(5,6)7)15-14(9-12)18(11-19-15)10-16(2,3)4/h8-10H,11H2,1-7H3/q+1/b18-10-