(Z)-3-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethylsulfanyl]-2-methyl-prop-2-enoic acid

Systemtic Name: (Z)-3-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethylsulfanyl]-2-methyl-prop-2-enoic acid Openeye Name: (Z)-3-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethylsulfanyl]-2-methyl-prop-2-enoic acid CAS Name: (Z)-3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethylthio]-2-methyl-2-propenoic acid IUPAC Name: (Z)-3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethylsulfanyl]-2-methylprop-2-enoic acid Traditional Name: (Z)-3-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethylthio]-2-methyl-acrylic acid Formula: C20H30O3S MolecularWeight: 350.5154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CSCCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)C(=O)O

Isomeric SMILES

C/C(=C/SCCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)/C(=O)O

InChI

InChI=1S/C20H30O3S/c1-13(18(22)23)12-24-9-8-14-10-15(19(2,3)4)17(21)16(11-14)20(5,6)7/h10-12,21H,8-9H2,1-7H3,(H,22,23)/b13-12-