4-methyl-2-(4-methylphenyl)sulfonyl-pent-4-enoic acid

Systemtic Name: 4-methyl-2-(4-methylphenyl)sulfonyl-pent-4-enoic acid Openeye Name: 4-methyl-2-(p-tolylsulfonyl)pent-4-enoic acid CAS Name: 4-methyl-2-(4-methylphenyl)sulfonyl-4-pentenoic acid IUPAC Name: 4-methyl-2-(4-methylphenyl)sulfonylpent-4-enoic acid Traditional Name: 4-methyl-2-tosyl-pent-4-enoic acid Formula: C13H16O4S MolecularWeight: 268.32874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O4S/c1-9(2)8-12(13(14)15)18(16,17)11-6-4-10(3)5-7-11/h4-7,12H,1,8H2,2-3H3,(H,14,15)