5-[2-(2,5-dimethylphenoxy)propanoylamino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[2-(2,5-dimethylphenoxy)propanoylamino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[2-(2,5-dimethylphenoxy)propanoylamino]benzene-1,3-dicarboxylic acid CAS Name: 5-[[2-(2,5-dimethylphenoxy)-1-oxopropyl]amino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[2-(2,5-dimethylphenoxy)propanoylamino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[2-(2,5-dimethylphenoxy)propanoylamino]isophthalic acid Formula: C19H19NO6 MolecularWeight: 357.35726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC(C)C(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC(C)C(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C19H19NO6/c1-10-4-5-11(2)16(6-10)26-12(3)17(21)20-15-8-13(18(22)23)7-14(9-15)19(24)25/h4-9,12H,1-3H3,(H,20,21)(H,22,23)(H,24,25)