(E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-(4-propan-2-ylphenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-(4-propan-2-ylphenyl)sulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-(4-isopropylphenyl)sulfonyl-prop-2-enenitrile CAS Name: (E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-2-(4-propan-2-ylphenyl)sulfonyl-2-propenenitrile IUPAC Name: (E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-2-(4-propan-2-ylphenyl)sulfonylprop-2-enenitrile Traditional Name: (E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-p-cumenylsulfonyl-acrylonitrile Formula: C26H33NO3S MolecularWeight: 439.61012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)C#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)/C(=C/C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)/C#N

InChI

InChI=1S/C26H33NO3S/c1-17(2)19-9-11-20(12-10-19)31(29,30)21(16-27)13-18-14-22(25(3,4)5)24(28)23(15-18)26(6,7)8/h9-15,17,28H,1-8H3/b21-13+