4-(3-methylsulfanylphenoxy)benzene-1,3-dicarboxylic acid

Systemtic Name: 4-(3-methylsulfanylphenoxy)benzene-1,3-dicarboxylic acid Openeye Name: 4-(3-methylsulfanylphenoxy)benzene-1,3-dicarboxylic acid CAS Name: 4-[3-(methylthio)phenoxy]benzene-1,3-dicarboxylic acid IUPAC Name: 4-(3-methylsulfanylphenoxy)benzene-1,3-dicarboxylic acid Traditional Name: 4-[3-(methylthio)phenoxy]isophthalic acid Formula: C15H12O5S MolecularWeight: 304.31778

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)OC2=C(C=C(C=C2)C(=O)O)C(=O)O

Isomeric SMILES

CSC1=CC=CC(=C1)OC2=C(C=C(C=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C15H12O5S/c1-21-11-4-2-3-10(8-11)20-13-6-5-9(14(16)17)7-12(13)15(18)19/h2-8H,1H3,(H,16,17)(H,18,19)