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

Systemtic Name: 1-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1-(phenylsulfonyl)pyrrol-3-yl]ethanone Openeye Name: 1-[1-(benzenesulfonyl)-2-(3,5-ditert-butyl-4-hydroxy-phenyl)pyrrol-3-yl]ethanone CAS Name: 1-[1-(benzenesulfonyl)-2-(3,5-ditert-butyl-4-hydroxyphenyl)-3-pyrrolyl]ethanone IUPAC Name: 1-[1-(benzenesulfonyl)-2-(3,5-ditert-butyl-4-hydroxyphenyl)pyrrol-3-yl]ethanone Traditional Name: 1-[1-besyl-2-(3,5-ditert-butyl-4-hydroxy-phenyl)pyrrol-3-yl]ethanone Formula: C26H31NO4S MolecularWeight: 453.59364

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N(C=C1)S(=O)(=O)C2=CC=CC=C2)C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC(=O)C1=C(N(C=C1)S(=O)(=O)C2=CC=CC=C2)C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C26H31NO4S/c1-17(28)20-13-14-27(32(30,31)19-11-9-8-10-12-19)23(20)18-15-21(25(2,3)4)24(29)22(16-18)26(5,6)7/h8-16,29H,1-7H3