4,6-bis[(4-methylsulfanylphenyl)carbonyl]benzene-1,3-dicarboxylic acid

Systemtic Name: 4,6-bis[(4-methylsulfanylphenyl)carbonyl]benzene-1,3-dicarboxylic acid Openeye Name: 4,6-bis(4-methylsulfanylbenzoyl)benzene-1,3-dicarboxylic acid CAS Name: 4,6-bis[[4-(methylthio)phenyl]-oxomethyl]benzene-1,3-dicarboxylic acid IUPAC Name: 4,6-bis(4-methylsulfanylbenzoyl)benzene-1,3-dicarboxylic acid Traditional Name: 4,6-bis[4-(methylthio)benzoyl]isophthalic acid Formula: C24H18O6S2 MolecularWeight: 466.52612

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2C(=O)O)C(=O)O)C(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2C(=O)O)C(=O)O)C(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C24H18O6S2/c1-31-15-7-3-13(4-8-15)21(25)17-11-18(20(24(29)30)12-19(17)23(27)28)22(26)14-5-9-16(32-2)10-6-14/h3-12H,1-2H3,(H,27,28)(H,29,30)