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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=C(C#N)S(=O)(=O)CC2CCC2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=C(\C#N)/S(=O)(=O)CC2CCC2

InChI

InChI=1S/C22H31NO3S/c1-21(2,3)18-11-16(12-19(20(18)24)22(4,5)6)10-17(13-23)27(25,26)14-15-8-7-9-15/h10-12,15,24H,7-9,14H2,1-6H3/b17-10+