5-[(4-tert-butylphenyl)sulfonylamino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[(4-tert-butylphenyl)sulfonylamino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[(4-tert-butylphenyl)sulfonylamino]benzene-1,3-dicarboxylic acid CAS Name: 5-[(4-tert-butylphenyl)sulfonylamino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[(4-tert-butylphenyl)sulfonylamino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[(4-tert-butylphenyl)sulfonylamino]isophthalic acid Formula: C18H19NO6S MolecularWeight: 377.41156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C18H19NO6S/c1-18(2,3)13-4-6-15(7-5-13)26(24,25)19-14-9-11(16(20)21)8-12(10-14)17(22)23/h4-10,19H,1-3H3,(H,20,21)(H,22,23)