2-[(2-bromanyl-4-fluoranyl-phenyl)methylsulfonyl]ethanoic acid

Systemtic Name: 2-[(2-bromanyl-4-fluoranyl-phenyl)methylsulfonyl]ethanoic acid Openeye Name: 2-[(2-bromo-4-fluoro-phenyl)methylsulfonyl]acetic acid CAS Name: 2-[(2-bromo-4-fluorophenyl)methylsulfonyl]acetic acid IUPAC Name: 2-[(2-bromo-4-fluorophenyl)methylsulfonyl]acetic acid Traditional Name: 2-(2-bromo-4-fluoro-benzyl)sulfonylacetic acid Formula: C9H8BrFO4S MolecularWeight: 311.124823

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)Br)CS(=O)(=O)CC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1F)Br)CS(=O)(=O)CC(=O)O

InChI

InChI=1S/C9H8BrFO4S/c10-8-3-7(11)2-1-6(8)4-16(14,15)5-9(12)13/h1-3H,4-5H2,(H,12,13)