(E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-sulfanyl-prop-2-enoic acid

Systemtic Name: (E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-sulfanyl-prop-2-enoic acid Openeye Name: (E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-sulfanyl-prop-2-enoic acid CAS Name: (E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-2-mercapto-2-propenoic acid IUPAC Name: (E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-2-sulfanylprop-2-enoic acid Traditional Name: (E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-mercapto-acrylic acid Formula: C17H24O3S MolecularWeight: 308.43566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=C(C(=O)O)S

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=C(\C(=O)O)/S

InChI

InChI=1S/C17H24O3S/c1-16(2,3)11-7-10(9-13(21)15(19)20)8-12(14(11)18)17(4,5)6/h7-9,18,21H,1-6H3,(H,19,20)/b13-9+