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

Systemtic Name: (3E)-7-tert-butyl-3-(2,2-dimethylpropylidene)-5-methyl-1,3-benzoxazol-3-ium-2-one Openeye Name: (3E)-7-tert-butyl-3-(2,2-dimethylpropylidene)-5-methyl-1,3-benzoxazol-3-ium-2-one CAS Name: (3E)-7-tert-butyl-3-(2,2-dimethylpropylidene)-5-methyl-1,3-benzoxazol-3-ium-2-one IUPAC Name: (3E)-7-tert-butyl-3-(2,2-dimethylpropylidene)-5-methyl-1,3-benzoxazol-3-ium-2-one Traditional Name: (3E)-7-tert-butyl-5-methyl-3-neopentylidene-1,3-benzoxazol-3-ium-2-one Formula: C17H24NO2+ MolecularWeight: 274.37796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)[N+](=CC(C)(C)C)C(=O)O2)C(C)(C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)/[N+](=C\C(C)(C)C)/C(=O)O2)C(C)(C)C

InChI

InChI=1S/C17H24NO2/c1-11-8-12(17(5,6)7)14-13(9-11)18(15(19)20-14)10-16(2,3)4/h8-10H,1-7H3/q+1/b18-10+