(E)-6-methylsulfonyloxyhept-3-enedioic acid

Systemtic Name: (E)-6-methylsulfonyloxyhept-3-enedioic acid Openeye Name: (E)-6-methylsulfonyloxyhept-3-enedioic acid CAS Name: (E)-6-methylsulfonyloxy-3-heptenedioic acid IUPAC Name: (E)-6-methylsulfonyloxyhept-3-enedioic acid Traditional Name: (E)-6-methylsulfonyloxyhept-3-enedioic acid Formula: C8H12O7S MolecularWeight: 252.24168

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC(CC=CCC(=O)O)C(=O)O

Isomeric SMILES

CS(=O)(=O)OC(C/C=C/CC(=O)O)C(=O)O

InChI

InChI=1S/C8H12O7S/c1-16(13,14)15-6(8(11)12)4-2-3-5-7(9)10/h2-3,6H,4-5H2,1H3,(H,9,10)(H,11,12)/b3-2+