(E)-2-(3-tert-butyl-4-oxidanyl-phenyl)-1-cyano-N-(3-phenylpropyl)ethenesulfonamide

Systemtic Name: (E)-2-(3-tert-butyl-4-oxidanyl-phenyl)-1-cyano-N-(3-phenylpropyl)ethenesulfonamide Openeye Name: (E)-2-(3-tert-butyl-4-hydroxy-phenyl)-1-cyano-N-(3-phenylpropyl)ethenesulfonamide CAS Name: (E)-2-(3-tert-butyl-4-hydroxyphenyl)-1-cyano-N-(3-phenylpropyl)ethenesulfonamide IUPAC Name: (E)-2-(3-tert-butyl-4-hydroxyphenyl)-1-cyano-N-(3-phenylpropyl)ethenesulfonamide Traditional Name: (E)-2-(3-tert-butyl-4-hydroxy-phenyl)-1-cyano-N-(3-phenylpropyl)ethenesulfonamide Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)C=C(C#N)S(=O)(=O)NCCCC2=CC=CC=C2)O

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)/C=C(\C#N)/S(=O)(=O)NCCCC2=CC=CC=C2)O

InChI

InChI=1S/C22H26N2O3S/c1-22(2,3)20-15-18(11-12-21(20)25)14-19(16-23)28(26,27)24-13-7-10-17-8-5-4-6-9-17/h4-6,8-9,11-12,14-15,24-25H,7,10,13H2,1-3H3/b19-14+