2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfonylethanenitrile

Systemtic Name: 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfonylethanenitrile Openeye Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfonylacetonitrile CAS Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfonylacetonitrile IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfonylacetonitrile Traditional Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfonylacetonitrile Formula: C16H23NO3S MolecularWeight: 309.42372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23NO3S/c1-15(2,3)12-9-11(21(19,20)8-7-17)10-13(14(12)18)16(4,5)6/h9-10,18H,8H2,1-6H3