(E)-1-cyano-2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-N-(phenylmethyl)ethenesulfonamide

Systemtic Name: (E)-1-cyano-2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-N-(phenylmethyl)ethenesulfonamide Openeye Name: (E)-N-benzyl-1-cyano-2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethenesulfonamide CAS Name: (E)-1-cyano-2-(3,5-ditert-butyl-4-hydroxyphenyl)-N-(phenylmethyl)ethenesulfonamide IUPAC Name: (E)-N-benzyl-1-cyano-2-(3,5-ditert-butyl-4-hydroxyphenyl)ethenesulfonamide Traditional Name: (E)-N-benzyl-1-cyano-2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethenesulfonamide Formula: C24H30N2O3S MolecularWeight: 426.5716

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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)NCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=C(\C#N)/S(=O)(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C24H30N2O3S/c1-23(2,3)20-13-18(14-21(22(20)27)24(4,5)6)12-19(15-25)30(28,29)26-16-17-10-8-7-9-11-17/h7-14,26-27H,16H2,1-6H3/b19-12+