4-[4-(4-methylphenyl)sulfonylbutoxy]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[4-(4-methylphenyl)sulfonylbutoxy]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-4-[4-(p-tolylsulfonyl)butoxy]benzoic acid CAS Name: 2-hydroxy-4-[4-(4-methylphenyl)sulfonylbutoxy]benzoic acid IUPAC Name: 2-hydroxy-4-[4-(4-methylphenyl)sulfonylbutoxy]benzoic acid Traditional Name: 2-hydroxy-4-(4-tosylbutoxy)benzoic acid Formula: C18H20O6S MolecularWeight: 364.4128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCCCOC2=CC(=C(C=C2)C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCCCOC2=CC(=C(C=C2)C(=O)O)O

InChI

InChI=1S/C18H20O6S/c1-13-4-7-15(8-5-13)25(22,23)11-3-2-10-24-14-6-9-16(18(20)21)17(19)12-14/h4-9,12,19H,2-3,10-11H2,1H3,(H,20,21)