3-[(5-chloranylthiophen-2-yl)methylsulfonyl]-5-fluoranyl-4-methyl-benzoic acid

Systemtic Name: 3-[(5-chloranylthiophen-2-yl)methylsulfonyl]-5-fluoranyl-4-methyl-benzoic acid Openeye Name: 3-[(5-chloro-2-thienyl)methylsulfonyl]-5-fluoro-4-methyl-benzoic acid CAS Name: 3-[(5-chloro-2-thiophenyl)methylsulfonyl]-5-fluoro-4-methylbenzoic acid IUPAC Name: 3-[(5-chlorothiophen-2-yl)methylsulfonyl]-5-fluoro-4-methylbenzoic acid Traditional Name: 3-[(5-chloro-2-thienyl)methylsulfonyl]-5-fluoro-4-methyl-benzoic acid Formula: C13H10ClFO4S2 MolecularWeight: 348.797503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1S(=O)(=O)CC2=CC=C(S2)Cl)C(=O)O)F

Isomeric SMILES

CC1=C(C=C(C=C1S(=O)(=O)CC2=CC=C(S2)Cl)C(=O)O)F

InChI

InChI=1S/C13H10ClFO4S2/c1-7-10(15)4-8(13(16)17)5-11(7)21(18,19)6-9-2-3-12(14)20-9/h2-5H,6H2,1H3,(H,16,17)