1-(5-bromanyl-1H-pyrrol-3-yl)-2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethanone

Systemtic Name: 1-(5-bromanyl-1H-pyrrol-3-yl)-2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethanone Openeye Name: 1-(5-bromo-1H-pyrrol-3-yl)-2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethanone CAS Name: 1-(5-bromo-1H-pyrrol-3-yl)-2-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone IUPAC Name: 1-(5-bromo-1H-pyrrol-3-yl)-2-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone Traditional Name: 1-(5-bromo-1H-pyrrol-3-yl)-2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethanone Formula: C20H26BrNO2 MolecularWeight: 392.32994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC(=O)C2=CNC(=C2)Br

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC(=O)C2=CNC(=C2)Br

InChI

InChI=1S/C20H26BrNO2/c1-19(2,3)14-7-12(8-15(18(14)24)20(4,5)6)9-16(23)13-10-17(21)22-11-13/h7-8,10-11,22,24H,9H2,1-6H3