3-[[2,6-bis(chloranyl)phenyl]methylsulfonyl]benzoic acid

Systemtic Name: 3-[[2,6-bis(chloranyl)phenyl]methylsulfonyl]benzoic acid Openeye Name: 3-[(2,6-dichlorophenyl)methylsulfonyl]benzoic acid CAS Name: 3-[(2,6-dichlorophenyl)methylsulfonyl]benzoic acid IUPAC Name: 3-[(2,6-dichlorophenyl)methylsulfonyl]benzoic acid Traditional Name: 3-(2,6-dichlorobenzyl)sulfonylbenzoic acid Formula: C14H10Cl2O4S MolecularWeight: 345.1978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)CC2=C(C=CC=C2Cl)Cl)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)CC2=C(C=CC=C2Cl)Cl)C(=O)O

InChI

InChI=1S/C14H10Cl2O4S/c15-12-5-2-6-13(16)11(12)8-21(19,20)10-4-1-3-9(7-10)14(17)18/h1-7H,8H2,(H,17,18)