(3,5-ditert-butyl-4-oxidanyl-phenyl)-(2-iodanyl-1-methyl-pyrrol-3-yl)methanone

Systemtic Name: (3,5-ditert-butyl-4-oxidanyl-phenyl)-(2-iodanyl-1-methyl-pyrrol-3-yl)methanone Openeye Name: (3,5-ditert-butyl-4-hydroxy-phenyl)-(2-iodo-1-methyl-pyrrol-3-yl)methanone CAS Name: (3,5-ditert-butyl-4-hydroxyphenyl)-(2-iodo-1-methyl-3-pyrrolyl)methanone IUPAC Name: (3,5-ditert-butyl-4-hydroxyphenyl)-(2-iodo-1-methylpyrrol-3-yl)methanone Traditional Name: (3,5-ditert-butyl-4-hydroxy-phenyl)-(2-iodo-1-methyl-pyrrol-3-yl)methanone Formula: C20H26INO2 MolecularWeight: 439.33041

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)C2=C(N(C=C2)C)I

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)C2=C(N(C=C2)C)I

InChI

InChI=1S/C20H26INO2/c1-19(2,3)14-10-12(11-15(17(14)24)20(4,5)6)16(23)13-8-9-22(7)18(13)21/h8-11,24H,1-7H3