(3,5-ditert-butyl-4-oxidanyl-phenyl)-[2,4,5-tris(bromanyl)-1-butan-2-yl-pyrrol-3-yl]methanone

Systemtic Name: (3,5-ditert-butyl-4-oxidanyl-phenyl)-[2,4,5-tris(bromanyl)-1-butan-2-yl-pyrrol-3-yl]methanone Openeye Name: (3,5-ditert-butyl-4-hydroxy-phenyl)-(2,4,5-tribromo-1-sec-butyl-pyrrol-3-yl)methanone CAS Name: (3,5-ditert-butyl-4-hydroxyphenyl)-(2,4,5-tribromo-1-butan-2-yl-3-pyrrolyl)methanone IUPAC Name: (3,5-ditert-butyl-4-hydroxyphenyl)-(2,4,5-tribromo-1-butan-2-ylpyrrol-3-yl)methanone Traditional Name: (3,5-ditert-butyl-4-hydroxy-phenyl)-(2,4,5-tribromo-1-sec-butyl-pyrrol-3-yl)methanone Formula: C23H30Br3NO2 MolecularWeight: 592.2018

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=C(C(=C1Br)Br)C(=O)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)Br

Isomeric SMILES

CCC(C)N1C(=C(C(=C1Br)Br)C(=O)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)Br

InChI

InChI=1S/C23H30Br3NO2/c1-9-12(2)27-20(25)16(17(24)21(27)26)18(28)13-10-14(22(3,4)5)19(29)15(11-13)23(6,7)8/h10-12,29H,9H2,1-8H3