(E)-2-(4-fluorophenyl)-3-(3-methylsulfonylphenyl)but-2-enoic acid

Systemtic Name: (E)-2-(4-fluorophenyl)-3-(3-methylsulfonylphenyl)but-2-enoic acid Openeye Name: (E)-2-(4-fluorophenyl)-3-(3-methylsulfonylphenyl)but-2-enoic acid CAS Name: (E)-2-(4-fluorophenyl)-3-(3-methylsulfonylphenyl)-2-butenoic acid IUPAC Name: (E)-2-(4-fluorophenyl)-3-(3-methylsulfonylphenyl)but-2-enoic acid Traditional Name: (E)-2-(4-fluorophenyl)-3-(3-mesylphenyl)but-2-enoic acid Formula: C17H15FO4S MolecularWeight: 334.362003

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C1=CC=C(C=C1)F)C(=O)O)C2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

C/C(=C(/C1=CC=C(C=C1)F)\C(=O)O)/C2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C17H15FO4S/c1-11(13-4-3-5-15(10-13)23(2,21)22)16(17(19)20)12-6-8-14(18)9-7-12/h3-10H,1-2H3,(H,19,20)/b16-11+