5-(3,4-dimethylphenyl)sulfonyloxybenzene-1,3-dicarboxylic acid

Systemtic Name: 5-(3,4-dimethylphenyl)sulfonyloxybenzene-1,3-dicarboxylic acid Openeye Name: 5-(3,4-dimethylphenyl)sulfonyloxybenzene-1,3-dicarboxylic acid CAS Name: 5-(3,4-dimethylphenyl)sulfonyloxybenzene-1,3-dicarboxylic acid IUPAC Name: 5-(3,4-dimethylphenyl)sulfonyloxybenzene-1,3-dicarboxylic acid Traditional Name: 5-(3,4-dimethylphenyl)sulfonyloxyisophthalic acid Formula: C16H14O7S MolecularWeight: 350.34316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)OC2=CC(=CC(=C2)C(=O)O)C(=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)OC2=CC(=CC(=C2)C(=O)O)C(=O)O)C

InChI

InChI=1S/C16H14O7S/c1-9-3-4-14(5-10(9)2)24(21,22)23-13-7-11(15(17)18)6-12(8-13)16(19)20/h3-8H,1-2H3,(H,17,18)(H,19,20)