2-(3-methylphenyl)sulfanylterephthalic acid

Systemtic Name: 2-(3-methylphenyl)sulfanylterephthalic acid Openeye Name: 2-(m-tolylsulfanyl)terephthalic acid CAS Name: 2-[(3-methylphenyl)thio]terephthalic acid IUPAC Name: 2-(3-methylphenyl)sulfanylterephthalic acid Traditional Name: 2-(m-tolylthio)terephthalic acid Formula: C15H12O4S MolecularWeight: 288.31838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)SC2=C(C=CC(=C2)C(=O)O)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)SC2=C(C=CC(=C2)C(=O)O)C(=O)O

InChI

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