4-[3-(4-hexoxyphenyl)sulfonylpropoxy]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[3-(4-hexoxyphenyl)sulfonylpropoxy]-2-oxidanyl-benzoic acid Openeye Name: 4-[3-(4-hexoxyphenyl)sulfonylpropoxy]-2-hydroxy-benzoic acid CAS Name: 4-[3-(4-hexoxyphenyl)sulfonylpropoxy]-2-hydroxybenzoic acid IUPAC Name: 4-[3-(4-hexoxyphenyl)sulfonylpropoxy]-2-hydroxybenzoic acid Traditional Name: 4-[3-(4-hexoxyphenyl)sulfonylpropoxy]-2-hydroxy-benzoic acid Formula: C22H28O7S MolecularWeight: 436.51852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)S(=O)(=O)CCCOC2=CC(=C(C=C2)C(=O)O)O

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)S(=O)(=O)CCCOC2=CC(=C(C=C2)C(=O)O)O

InChI

InChI=1S/C22H28O7S/c1-2-3-4-5-13-28-17-7-10-19(11-8-17)30(26,27)15-6-14-29-18-9-12-20(22(24)25)21(23)16-18/h7-12,16,23H,2-6,13-15H2,1H3,(H,24,25)