(3,5-ditert-butyl-4-oxidanyl-phenyl)-[1-methyl-5-(trifluoromethyl)pyrrol-3-yl]methanone

Systemtic Name: (3,5-ditert-butyl-4-oxidanyl-phenyl)-[1-methyl-5-(trifluoromethyl)pyrrol-3-yl]methanone Openeye Name: (3,5-ditert-butyl-4-hydroxy-phenyl)-[1-methyl-5-(trifluoromethyl)pyrrol-3-yl]methanone CAS Name: (3,5-ditert-butyl-4-hydroxyphenyl)-[1-methyl-5-(trifluoromethyl)-3-pyrrolyl]methanone IUPAC Name: (3,5-ditert-butyl-4-hydroxyphenyl)-[1-methyl-5-(trifluoromethyl)pyrrol-3-yl]methanone Traditional Name: (3,5-ditert-butyl-4-hydroxy-phenyl)-[1-methyl-5-(trifluoromethyl)pyrrol-3-yl]methanone Formula: C21H26F3NO2 MolecularWeight: 381.43185

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)C2=CN(C(=C2)C(F)(F)F)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)C2=CN(C(=C2)C(F)(F)F)C

InChI

InChI=1S/C21H26F3NO2/c1-19(2,3)14-8-12(9-15(18(14)27)20(4,5)6)17(26)13-10-16(21(22,23)24)25(7)11-13/h8-11,27H,1-7H3