2-chloranyl-4-methylsulfonyl-3-phenyl-benzoic acid

Systemtic Name: 2-chloranyl-4-methylsulfonyl-3-phenyl-benzoic acid Openeye Name: 2-chloro-4-methylsulfonyl-3-phenyl-benzoic acid CAS Name: 2-chloro-4-methylsulfonyl-3-phenylbenzoic acid IUPAC Name: 2-chloro-4-methylsulfonyl-3-phenylbenzoic acid Traditional Name: 2-chloro-4-mesyl-3-phenyl-benzoic acid Formula: C14H11ClO4S MolecularWeight: 310.75274

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)O)Cl)C2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)O)Cl)C2=CC=CC=C2

InChI

InChI=1S/C14H11ClO4S/c1-20(18,19)11-8-7-10(14(16)17)13(15)12(11)9-5-3-2-4-6-9/h2-8H,1H3,(H,16,17)