5-[(4-hydroxyphenyl)methylsulfonyl]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[(4-hydroxyphenyl)methylsulfonyl]benzene-1,3-dicarboxylic acid Openeye Name: 5-[(4-hydroxyphenyl)methylsulfonyl]benzene-1,3-dicarboxylic acid CAS Name: 5-[(4-hydroxyphenyl)methylsulfonyl]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[(4-hydroxyphenyl)methylsulfonyl]benzene-1,3-dicarboxylic acid Traditional Name: 5-(4-hydroxybenzyl)sulfonylisophthalic acid Formula: C15H12O7S MolecularWeight: 336.31658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CS(=O)(=O)C2=CC(=CC(=C2)C(=O)O)C(=O)O)O

Isomeric SMILES

C1=CC(=CC=C1CS(=O)(=O)C2=CC(=CC(=C2)C(=O)O)C(=O)O)O

InChI

InChI=1S/C15H12O7S/c16-12-3-1-9(2-4-12)8-23(21,22)13-6-10(14(17)18)5-11(7-13)15(19)20/h1-7,16H,8H2,(H,17,18)(H,19,20)