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(3E)-5,7-ditert-butyl-3-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-benzoxazol-3-ium-2-one
(3E)-5,7-ditert-butyl-3-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-benzoxazol-3-ium-2-one
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Canonical SMILES:
CC(C)(C)C1=CC(=C2C(=C1)[N+](=CC3=CC(=C(C(=C3)OC)OC)OC)C(=O)O2)C(C)(C)C
Isomeric SMILES
CC(C)(C)C1=CC(=C2C(=C1)/[N+](=C\C3=CC(=C(C(=C3)OC)OC)OC)/C(=O)O2)C(C)(C)C
InChI
InChI=1S/C25H32NO5/c1-24(2,3)16-12-17(25(4,5)6)21-18(13-16)26(23(27)31-21)14-15-10-19(28-7)22(30-9)20(11-15)29-8/h10-14H,1-9H3/q+1/b26-14+
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- (3E)-7-tert-butyl-5-methyl-3-(2-methylpropylidene)-2H-1,3-benzoxazol-3-ium
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