3-(2-chloranyl-4-methylsulfonyl-phenoxy)benzoate

Systemtic Name: 3-(2-chloranyl-4-methylsulfonyl-phenoxy)benzoate Openeye Name: 3-(2-chloro-4-methylsulfonyl-phenoxy)benzoate CAS Name: 3-(2-chloro-4-methylsulfonylphenoxy)benzoate IUPAC Name: 3-(2-chloro-4-methylsulfonylphenoxy)benzoate Traditional Name: 3-(2-chloro-4-mesyl-phenoxy)benzoate Formula: C14H10ClO5S- MolecularWeight: 325.7442

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)OC2=CC=CC(=C2)C(=O)[O-])Cl

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)OC2=CC=CC(=C2)C(=O)[O-])Cl

InChI

InChI=1S/C14H11ClO5S/c1-21(18,19)11-5-6-13(12(15)8-11)20-10-4-2-3-9(7-10)14(16)17/h2-8H,1H3,(H,16,17)/p-1