5-[[3-(2,2-dimethylpropanoylamino)phenyl]carbonylamino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[[3-(2,2-dimethylpropanoylamino)phenyl]carbonylamino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[[3-(2,2-dimethylpropanoylamino)benzoyl]amino]benzene-1,3-dicarboxylic acid CAS Name: 5-[[[3-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[[3-(2,2-dimethylpropanoylamino)benzoyl]amino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[[3-(pivaloylamino)benzoyl]amino]isophthalic acid Formula: C20H20N2O6 MolecularWeight: 384.3826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=CC(=C1)C(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=CC(=C1)C(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C20H20N2O6/c1-20(2,3)19(28)22-14-6-4-5-11(8-14)16(23)21-15-9-12(17(24)25)7-13(10-15)18(26)27/h4-10H,1-3H3,(H,21,23)(H,22,28)(H,24,25)(H,26,27)