2-[2,5-di(propan-2-yl)phenyl]sulfanylpropanedioic acid

Systemtic Name: 2-[2,5-di(propan-2-yl)phenyl]sulfanylpropanedioic acid Openeye Name: 2-(2,5-diisopropylphenyl)sulfanylpropanedioic acid CAS Name: 2-[[2,5-di(propan-2-yl)phenyl]thio]propanedioic acid IUPAC Name: 2-[2,5-di(propan-2-yl)phenyl]sulfanylpropanedioic acid Traditional Name: 2-[(2,5-diisopropylphenyl)thio]malonic acid Formula: C15H20O4S MolecularWeight: 296.3819

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20O4S/c1-8(2)10-5-6-11(9(3)4)12(7-10)20-13(14(16)17)15(18)19/h5-9,13H,1-4H3,(H,16,17)(H,18,19)