(E)-2-[2,4-di(propan-2-yl)phenyl]sulfanylbut-2-enedioic acid

Systemtic Name: (E)-2-[2,4-di(propan-2-yl)phenyl]sulfanylbut-2-enedioic acid Openeye Name: (E)-2-(2,4-diisopropylphenyl)sulfanylbut-2-enedioic acid CAS Name: (E)-2-[[2,4-di(propan-2-yl)phenyl]thio]-2-butenedioic acid IUPAC Name: (E)-2-[2,4-di(propan-2-yl)phenyl]sulfanylbut-2-enedioic acid Traditional Name: (E)-2-[(2,4-diisopropylphenyl)thio]but-2-enedioic acid Formula: C16H20O4S MolecularWeight: 308.3926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)SC(=CC(=O)O)C(=O)O)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C16H20O4S/c1-9(2)11-5-6-13(12(7-11)10(3)4)21-14(16(19)20)8-15(17)18/h5-10H,1-4H3,(H,17,18)(H,19,20)/b14-8+