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

Systemtic Name: (3E)-5,7-ditert-butyl-3-(2,2-dimethylpropylidene)-1,3-benzoxazol-3-ium-2-one Openeye Name: (3E)-5,7-ditert-butyl-3-(2,2-dimethylpropylidene)-1,3-benzoxazol-3-ium-2-one CAS Name: (3E)-5,7-ditert-butyl-3-(2,2-dimethylpropylidene)-1,3-benzoxazol-3-ium-2-one IUPAC Name: (3E)-5,7-ditert-butyl-3-(2,2-dimethylpropylidene)-1,3-benzoxazol-3-ium-2-one Traditional Name: (3E)-5,7-ditert-butyl-3-neopentylidene-1,3-benzoxazol-3-ium-2-one Formula: C20H30NO2+ MolecularWeight: 316.4577

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C=[N+]1C2=CC(=CC(=C2OC1=O)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC(C)(C)/C=[N+]/1\C2=CC(=CC(=C2OC1=O)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C20H30NO2/c1-18(2,3)12-21-15-11-13(19(4,5)6)10-14(20(7,8)9)16(15)23-17(21)22/h10-12H,1-9H3/q+1/b21-12+