(E)-8-methyl-5-(4-methylphenyl)sulfonyl-6-oxidanyl-non-4-enoic acid

Systemtic Name: (E)-8-methyl-5-(4-methylphenyl)sulfonyl-6-oxidanyl-non-4-enoic acid Openeye Name: (E)-6-hydroxy-8-methyl-5-(p-tolylsulfonyl)non-4-enoic acid CAS Name: (E)-6-hydroxy-8-methyl-5-(4-methylphenyl)sulfonyl-4-nonenoic acid IUPAC Name: (E)-6-hydroxy-8-methyl-5-(4-methylphenyl)sulfonylnon-4-enoic acid Traditional Name: (E)-6-hydroxy-8-methyl-5-tosyl-non-4-enoic acid Formula: C17H24O5S MolecularWeight: 340.43446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CCCC(=O)O)C(CC(C)C)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=C/CCC(=O)O)/C(CC(C)C)O

InChI

InChI=1S/C17H24O5S/c1-12(2)11-15(18)16(5-4-6-17(19)20)23(21,22)14-9-7-13(3)8-10-14/h5,7-10,12,15,18H,4,6,11H2,1-3H3,(H,19,20)/b16-5+