(E)-2-(4-tert-butylphenyl)sulfanylbut-2-enedioate

Systemtic Name: (E)-2-(4-tert-butylphenyl)sulfanylbut-2-enedioate Openeye Name: (E)-2-(4-tert-butylphenyl)sulfanylbut-2-enedioate CAS Name: (E)-2-[(4-tert-butylphenyl)thio]-2-butenedioate IUPAC Name: (E)-2-(4-tert-butylphenyl)sulfanylbut-2-enedioate Traditional Name: (E)-2-[(4-tert-butylphenyl)thio]but-2-enedioate Formula: C14H14O4S-2 MolecularWeight: 278.32356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SC(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S/C(=C/C(=O)[O-])/C(=O)[O-]

InChI

InChI=1S/C14H16O4S/c1-14(2,3)9-4-6-10(7-5-9)19-11(13(17)18)8-12(15)16/h4-8H,1-3H3,(H,15,16)(H,17,18)/p-2/b11-8+