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

Systemtic Name: (E)-2-cyclopentylsulfonyl-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)prop-2-enenitrile Openeye Name: (E)-2-cyclopentylsulfonyl-3-(3,5-ditert-butyl-4-hydroxy-phenyl)prop-2-enenitrile CAS Name: (E)-2-cyclopentylsulfonyl-3-(3,5-ditert-butyl-4-hydroxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-cyclopentylsulfonyl-3-(3,5-ditert-butyl-4-hydroxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-cyclopentylsulfonyl-3-(3,5-ditert-butyl-4-hydroxy-phenyl)acrylonitrile Formula: C22H31NO3S MolecularWeight: 389.55144

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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)C2CCCC2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=C(\C#N)/S(=O)(=O)C2CCCC2

InChI

InChI=1S/C22H31NO3S/c1-21(2,3)18-12-15(13-19(20(18)24)22(4,5)6)11-17(14-23)27(25,26)16-9-7-8-10-16/h11-13,16,24H,7-10H2,1-6H3/b17-11+