(2Z)-2-[(3,5-ditert-butyl-5-oxidanyl-cyclohexa-1,3-dien-1-yl)methylidene]-4-methylsulfonyl-thiomorpholin-3-one

Systemtic Name: (2Z)-2-[(3,5-ditert-butyl-5-oxidanyl-cyclohexa-1,3-dien-1-yl)methylidene]-4-methylsulfonyl-thiomorpholin-3-one Openeye Name: (2Z)-2-[(3,5-ditert-butyl-5-hydroxy-cyclohexa-1,3-dien-1-yl)methylene]-4-methylsulfonyl-thiomorpholin-3-one CAS Name: (2Z)-2-[(3,5-ditert-butyl-5-hydroxy-1-cyclohexa-1,3-dienyl)methylidene]-4-methylsulfonyl-3-thiomorpholinone IUPAC Name: (2Z)-2-[(3,5-ditert-butyl-5-hydroxycyclohexa-1,3-dien-1-yl)methylidene]-4-methylsulfonylthiomorpholin-3-one Traditional Name: (2Z)-2-[(3,5-ditert-butyl-5-hydroxy-cyclohexa-1,3-dien-1-yl)methylene]-4-mesyl-thiomorpholin-3-one Formula: C20H31NO4S2 MolecularWeight: 413.59444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(CC(=C1)C=C2C(=O)N(CCS2)S(=O)(=O)C)(C(C)(C)C)O

Isomeric SMILES

CC(C)(C)C1=CC(CC(=C1)/C=C\2/C(=O)N(CCS2)S(=O)(=O)C)(C(C)(C)C)O

InChI

InChI=1S/C20H31NO4S2/c1-18(2,3)15-10-14(12-20(23,13-15)19(4,5)6)11-16-17(22)21(8-9-26-16)27(7,24)25/h10-11,13,23H,8-9,12H2,1-7H3/b16-11-