4-(4-chloranylsulfonylphenoxy)-3-methylsulfonyl-benzoic acid

Systemtic Name: 4-(4-chloranylsulfonylphenoxy)-3-methylsulfonyl-benzoic acid Openeye Name: 4-(4-chlorosulfonylphenoxy)-3-methylsulfonyl-benzoic acid CAS Name: 4-(4-chlorosulfonylphenoxy)-3-methylsulfonylbenzoic acid IUPAC Name: 4-(4-chlorosulfonylphenoxy)-3-methylsulfonylbenzoic acid Traditional Name: 4-(4-chlorosulfonylphenoxy)-3-mesyl-benzoic acid Formula: C14H11ClO7S2 MolecularWeight: 390.81594

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)OC2=CC=C(C=C2)S(=O)(=O)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)OC2=CC=C(C=C2)S(=O)(=O)Cl

InChI

InChI=1S/C14H11ClO7S2/c1-23(18,19)13-8-9(14(16)17)2-7-12(13)22-10-3-5-11(6-4-10)24(15,20)21/h2-8H,1H3,(H,16,17)