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

Systemtic Name: (E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-(3,4-dimethoxyphenyl)sulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-(3,4-dimethoxyphenyl)sulfonyl-prop-2-enenitrile CAS Name: (E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-2-(3,4-dimethoxyphenyl)sulfonyl-2-propenenitrile IUPAC Name: (E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-2-(3,4-dimethoxyphenyl)sulfonylprop-2-enenitrile Traditional Name: (E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-(3,4-dimethoxyphenyl)sulfonyl-acrylonitrile Formula: C25H31NO5S MolecularWeight: 457.58234

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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)OC)OC

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)OC)OC

InChI

InChI=1S/C25H31NO5S/c1-24(2,3)19-12-16(13-20(23(19)27)25(4,5)6)11-18(15-26)32(28,29)17-9-10-21(30-7)22(14-17)31-8/h9-14,27H,1-8H3/b18-11+