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

Systemtic Name: (E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-(4-methylsulfonylphenyl)sulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-(4-methylsulfonylphenyl)sulfonyl-prop-2-enenitrile CAS Name: (E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-2-(4-methylsulfonylphenyl)sulfonyl-2-propenenitrile IUPAC Name: (E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-2-(4-methylsulfonylphenyl)sulfonylprop-2-enenitrile Traditional Name: (E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-(4-mesylphenyl)sulfonyl-acrylonitrile Formula: C24H29NO5S2 MolecularWeight: 475.62076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=C(\C#N)/S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C24H29NO5S2/c1-23(2,3)20-13-16(14-21(22(20)26)24(4,5)6)12-19(15-25)32(29,30)18-10-8-17(9-11-18)31(7,27)28/h8-14,26H,1-7H3/b19-12+