2-(4-methylphenyl)sulfanylbenzene-1,3-dicarboxylic acid

Systemtic Name: 2-(4-methylphenyl)sulfanylbenzene-1,3-dicarboxylic acid Openeye Name: 2-(p-tolylsulfanyl)benzene-1,3-dicarboxylic acid CAS Name: 2-[(4-methylphenyl)thio]benzene-1,3-dicarboxylic acid IUPAC Name: 2-(4-methylphenyl)sulfanylbenzene-1,3-dicarboxylic acid Traditional Name: 2-(p-tolylthio)isophthalic acid Formula: C15H12O4S MolecularWeight: 288.31838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=CC=C2C(=O)O)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=CC=C2C(=O)O)C(=O)O

InChI

InChI=1S/C15H12O4S/c1-9-5-7-10(8-6-9)20-13-11(14(16)17)3-2-4-12(13)15(18)19/h2-8H,1H3,(H,16,17)(H,18,19)