5-[[4-(2-methylphenoxy)phenyl]sulfonylamino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[[4-(2-methylphenoxy)phenyl]sulfonylamino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[[4-(2-methylphenoxy)phenyl]sulfonylamino]benzene-1,3-dicarboxylic acid CAS Name: 5-[[4-(2-methylphenoxy)phenyl]sulfonylamino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[[4-(2-methylphenoxy)phenyl]sulfonylamino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[[4-(2-methylphenoxy)phenyl]sulfonylamino]isophthalic acid Formula: C21H17NO7S MolecularWeight: 427.42718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2=CC=C(C=C2)S(=O)(=O)NC3=CC(=CC(=C3)C(=O)O)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1OC2=CC=C(C=C2)S(=O)(=O)NC3=CC(=CC(=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C21H17NO7S/c1-13-4-2-3-5-19(13)29-17-6-8-18(9-7-17)30(27,28)22-16-11-14(20(23)24)10-15(12-16)21(25)26/h2-12,22H,1H3,(H,23,24)(H,25,26)