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5-[3-(4-methylphenyl)sulfinylpropoxy]-2-oxidanyl-benzoic acid

5-[3-(4-methylphenyl)sulfinylpropoxy]-2-oxidanyl-benzoic acid

Systemtic Name:5-[3-(4-methylphenyl)sulfinylpropoxy]-2-oxidanyl-benzoic acid
Openeye Name:2-hydroxy-5-[3-(p-tolylsulfinyl)propoxy]benzoic acid
CAS Name:2-hydroxy-5-[3-(4-methylphenyl)sulfinylpropoxy]benzoic acid
IUPAC Name:2-hydroxy-5-[3-(4-methylphenyl)sulfinylpropoxy]benzoic acid
Traditional Name:2-hydroxy-5-[3-(p-tolylsulfinyl)propoxy]benzoic acid
Formula: C17H18O5S
MolecularWeight: 334.38682
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)CCCOC2=CC(=C(C=C2)O)C(=O)O


Isomeric SMILES

CC1=CC=C(C=C1)S(=O)CCCOC2=CC(=C(C=C2)O)C(=O)O


InChI

InChI=1S/C17H18O5S/c1-12-3-6-14(7-4-12)23(21)10-2-9-22-13-5-8-16(18)15(11-13)17(19)20/h3-8,11,18H,2,9-10H2,1H3,(H,19,20)


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