2,4-bis(chloranyl)-5-(oxan-2-ylmethylsulfonyl)benzoic acid

Systemtic Name: 2,4-bis(chloranyl)-5-(oxan-2-ylmethylsulfonyl)benzoic acid Openeye Name: 2,4-dichloro-5-(tetrahydropyran-2-ylmethylsulfonyl)benzoic acid CAS Name: 2,4-dichloro-5-(2-oxanylmethylsulfonyl)benzoic acid IUPAC Name: 2,4-dichloro-5-(oxan-2-ylmethylsulfonyl)benzoic acid Traditional Name: 2,4-dichloro-5-(tetrahydropyran-2-ylmethylsulfonyl)benzoic acid Formula: C13H14Cl2O5S MolecularWeight: 353.21826

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CS(=O)(=O)C2=C(C=C(C(=C2)C(=O)O)Cl)Cl

Isomeric SMILES

C1CCOC(C1)CS(=O)(=O)C2=C(C=C(C(=C2)C(=O)O)Cl)Cl

InChI

InChI=1S/C13H14Cl2O5S/c14-10-6-11(15)12(5-9(10)13(16)17)21(18,19)7-8-3-1-2-4-20-8/h5-6,8H,1-4,7H2,(H,16,17)