(E)-4-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-(ethylsulfamoyl)but-3-enoic acid

Systemtic Name: (E)-4-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-(ethylsulfamoyl)but-3-enoic acid Openeye Name: (E)-4-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-(ethylsulfamoyl)but-3-enoic acid CAS Name: (E)-4-(3,5-ditert-butyl-4-hydroxyphenyl)-2-(ethylsulfamoyl)-3-butenoic acid IUPAC Name: (E)-4-(3,5-ditert-butyl-4-hydroxyphenyl)-2-(ethylsulfamoyl)but-3-enoic acid Traditional Name: (E)-4-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-(ethylsulfamoyl)but-3-enoic acid Formula: C20H31NO5S MolecularWeight: 397.52884

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Descriptors Computed from Structure

Canonical SMILES:

CCNS(=O)(=O)C(C=CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)C(=O)O

Isomeric SMILES

CCNS(=O)(=O)C(/C=C/C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)C(=O)O

InChI

InChI=1S/C20H31NO5S/c1-8-21-27(25,26)16(18(23)24)10-9-13-11-14(19(2,3)4)17(22)15(12-13)20(5,6)7/h9-12,16,21-22H,8H2,1-7H3,(H,23,24)/b10-9+