4-butylsulfonylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid

Systemtic Name: 4-butylsulfonylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid Openeye Name: 4-butylsulfonylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid CAS Name: 4-butylsulfonylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid IUPAC Name: 4-butylsulfonylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid Traditional Name: 4-butylsulfonylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid Formula: C13H18O6S MolecularWeight: 302.34342

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)C12CC(C=C1)C(C2C(=O)O)C(=O)O

Isomeric SMILES

CCCCS(=O)(=O)C12CC(C=C1)C(C2C(=O)O)C(=O)O

InChI

InChI=1S/C13H18O6S/c1-2-3-6-20(18,19)13-5-4-8(7-13)9(11(14)15)10(13)12(16)17/h4-5,8-10H,2-3,6-7H2,1H3,(H,14,15)(H,16,17)