5-(2,2-dimethylpropanoylamino)benzene-1,3-dicarboxylic acid

Systemtic Name: 5-(2,2-dimethylpropanoylamino)benzene-1,3-dicarboxylic acid Openeye Name: 5-(2,2-dimethylpropanoylamino)benzene-1,3-dicarboxylic acid CAS Name: 5-[(2,2-dimethyl-1-oxopropyl)amino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-(2,2-dimethylpropanoylamino)benzene-1,3-dicarboxylic acid Traditional Name: 5-(pivaloylamino)isophthalic acid Formula: C13H15NO5 MolecularWeight: 265.2619

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO5/c1-13(2,3)12(19)14-9-5-7(10(15)16)4-8(6-9)11(17)18/h4-6H,1-3H3,(H,14,19)(H,15,16)(H,17,18)