3-methyl-2-(4-methylphenyl)sulfonyloxy-but-2-enoic acid

Systemtic Name: 3-methyl-2-(4-methylphenyl)sulfonyloxy-but-2-enoic acid Openeye Name: 3-methyl-2-(p-tolylsulfonyloxy)but-2-enoic acid CAS Name: 3-methyl-2-(4-methylphenyl)sulfonyloxy-2-butenoic acid IUPAC Name: 3-methyl-2-(4-methylphenyl)sulfonyloxybut-2-enoic acid Traditional Name: 3-methyl-2-tosyloxy-but-2-enoic acid Formula: C12H14O5S MolecularWeight: 270.30156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14O5S/c1-8(2)11(12(13)14)17-18(15,16)10-6-4-9(3)5-7-10/h4-7H,1-3H3,(H,13,14)