3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1-(1-methyl-5-methylsulfinyl-pyrrol-3-yl)propan-1-one

Systemtic Name: 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1-(1-methyl-5-methylsulfinyl-pyrrol-3-yl)propan-1-one Openeye Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)-1-(1-methyl-5-methylsulfinyl-pyrrol-3-yl)propan-1-one CAS Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-(1-methyl-5-methylsulfinyl-3-pyrrolyl)-1-propanone IUPAC Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-(1-methyl-5-methylsulfinylpyrrol-3-yl)propan-1-one Traditional Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)-1-(1-methyl-5-methylsulfinyl-pyrrol-3-yl)propan-1-one Formula: C23H33NO3S MolecularWeight: 403.57802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)C2=CN(C(=C2)S(=O)C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)C2=CN(C(=C2)S(=O)C)C

InChI

InChI=1S/C23H33NO3S/c1-22(2,3)17-11-15(12-18(21(17)26)23(4,5)6)9-10-19(25)16-13-20(28(8)27)24(7)14-16/h11-14,26H,9-10H2,1-8H3