2,5-bis[(4-methylphenyl)sulfonylamino]terephthalic acid

Systemtic Name: 2,5-bis[(4-methylphenyl)sulfonylamino]terephthalic acid Openeye Name: 2,5-bis(p-tolylsulfonylamino)terephthalic acid CAS Name: 2,5-bis[(4-methylphenyl)sulfonylamino]terephthalic acid IUPAC Name: 2,5-bis[(4-methylphenyl)sulfonylamino]terephthalic acid Traditional Name: 2,5-bis(tosylamino)terephthalic acid Formula: C22H20N2O8S2 MolecularWeight: 504.5328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)C)C(=O)O

InChI

InChI=1S/C22H20N2O8S2/c1-13-3-7-15(8-4-13)33(29,30)23-19-11-18(22(27)28)20(12-17(19)21(25)26)24-34(31,32)16-9-5-14(2)6-10-16/h3-12,23-24H,1-2H3,(H,25,26)(H,27,28)