2-chloranyl-4-fluoranyl-5-propan-2-ylsulfonyl-benzoic acid

Systemtic Name: 2-chloranyl-4-fluoranyl-5-propan-2-ylsulfonyl-benzoic acid Openeye Name: 2-chloro-4-fluoro-5-isopropylsulfonyl-benzoic acid CAS Name: 2-chloro-4-fluoro-5-propan-2-ylsulfonylbenzoic acid IUPAC Name: 2-chloro-4-fluoro-5-propan-2-ylsulfonylbenzoic acid Traditional Name: 2-chloro-4-fluoro-5-isopropylsulfonyl-benzoic acid Formula: C10H10ClFO4S MolecularWeight: 280.700403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10ClFO4S/c1-5(2)17(15,16)9-3-6(10(13)14)7(11)4-8(9)12/h3-5H,1-2H3,(H,13,14)