1-[2,5-bis(chloranyl)-1H-pyrrol-3-yl]-2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethanone

Systemtic Name: 1-[2,5-bis(chloranyl)-1H-pyrrol-3-yl]-2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethanone Openeye Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)-1-(2,5-dichloro-1H-pyrrol-3-yl)ethanone CAS Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-1-(2,5-dichloro-1H-pyrrol-3-yl)ethanone IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-1-(2,5-dichloro-1H-pyrrol-3-yl)ethanone Traditional Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)-1-(2,5-dichloro-1H-pyrrol-3-yl)ethanone Formula: C20H25Cl2NO2 MolecularWeight: 382.324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC(=O)C2=C(NC(=C2)Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC(=O)C2=C(NC(=C2)Cl)Cl

InChI

InChI=1S/C20H25Cl2NO2/c1-19(2,3)13-7-11(8-14(17(13)25)20(4,5)6)9-15(24)12-10-16(21)23-18(12)22/h7-8,10,23,25H,9H2,1-6H3