4-[2-chloranyl-3-(4-methylphenyl)sulfonyl-propoxy]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[2-chloranyl-3-(4-methylphenyl)sulfonyl-propoxy]-2-oxidanyl-benzoic acid Openeye Name: 4-[2-chloro-3-(p-tolylsulfonyl)propoxy]-2-hydroxy-benzoic acid CAS Name: 4-[2-chloro-3-(4-methylphenyl)sulfonylpropoxy]-2-hydroxybenzoic acid IUPAC Name: 4-[2-chloro-3-(4-methylphenyl)sulfonylpropoxy]-2-hydroxybenzoic acid Traditional Name: 4-(2-chloro-3-tosyl-propoxy)-2-hydroxy-benzoic acid Formula: C17H17ClO6S MolecularWeight: 384.83128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(COC2=CC(=C(C=C2)C(=O)O)O)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(COC2=CC(=C(C=C2)C(=O)O)O)Cl

InChI

InChI=1S/C17H17ClO6S/c1-11-2-5-14(6-3-11)25(22,23)10-12(18)9-24-13-4-7-15(17(20)21)16(19)8-13/h2-8,12,19H,9-10H2,1H3,(H,20,21)